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Organoheterocyclic compounds

Organic compounds that consist of ring structures, or cyclic compounds that have atoms of at least two different elements as members of its ring(s).
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1 – 15 of 1,288 results
1

5-Bromo-1-methyl-1H-indole, 97%, Thermo Scientific™

CAS: 10075-52-2 Molecular Formula: C9H8BrN Molecular Weight (g/mol): 210.07 MDL Number: MFCD00159857 InChI Key: SBOITLSQLQGSLO-UHFFFAOYSA-N PubChem CID: 285757 IUPAC Name: 5-bromo-1-methylindole SMILES: CN1C=CC2=CC(Br)=CC=C12

PubChem CID 285757
CAS 10075-52-2
Molecular Weight (g/mol) 210.07
MDL Number MFCD00159857
SMILES CN1C=CC2=CC(Br)=CC=C12
IUPAC Name 5-bromo-1-methylindole
InChI Key SBOITLSQLQGSLO-UHFFFAOYSA-N
Molecular Formula C9H8BrN
2

2-Bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone, 97%, Thermo Scientific™

CAS: 19815-97-5 Molecular Formula: C10H9BrO3 Molecular Weight (g/mol): 257.08 MDL Number: MFCD04972617 InChI Key: BSROYFIAEPSLCT-UHFFFAOYSA-N Synonym: 2-bromo-1-2,3-dihydrobenzo b 1,4 dioxin-5-yl ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl-1-ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,5-bromoacetyl-1,4-benzodioxane,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethan-1-one,5-bromoacetyl-2,3-dihydro-1,4-benzodioxine,2-bromanyl-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,1-2h,3h-benzo 2,3-e 1,4-dioxin-5-yl-2-bromoethan-1-one,ethanone, 2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl PubChem CID: 2795035 IUPAC Name: 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone SMILES: BrCC(=O)C1=C2OCCOC2=CC=C1

PubChem CID 2795035
CAS 19815-97-5
Molecular Weight (g/mol) 257.08
MDL Number MFCD04972617
SMILES BrCC(=O)C1=C2OCCOC2=CC=C1
Synonym 2-bromo-1-2,3-dihydrobenzo b 1,4 dioxin-5-yl ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl-1-ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,5-bromoacetyl-1,4-benzodioxane,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethan-1-one,5-bromoacetyl-2,3-dihydro-1,4-benzodioxine,2-bromanyl-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,1-2h,3h-benzo 2,3-e 1,4-dioxin-5-yl-2-bromoethan-1-one,ethanone, 2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl
IUPAC Name 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone
InChI Key BSROYFIAEPSLCT-UHFFFAOYSA-N
Molecular Formula C10H9BrO3
3

2-Methyl-1,3-thiazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 35272-15-2 Molecular Formula: C5H5NO2S Molecular Weight (g/mol): 143.16 MDL Number: MFCD03407332 InChI Key: ZHDRDZMTEOIWSX-UHFFFAOYSA-N Synonym: 2-methylthiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylic acid,4-thiazolecarboxylic acid, 2-methyl,2-methyl-thiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylicacid,2-methyl-thiazole4-carboxylic acid,4-thiazolecarboxylicacid, 2-methyl,2-methyl-1,3-thiazole-4-carboxylicacid PubChem CID: 284728 IUPAC Name: 2-methyl-1,3-thiazole-4-carboxylic acid SMILES: CC1=NC(=CS1)C(=O)O

PubChem CID 284728
CAS 35272-15-2
Molecular Weight (g/mol) 143.16
MDL Number MFCD03407332
SMILES CC1=NC(=CS1)C(=O)O
Synonym 2-methylthiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylic acid,4-thiazolecarboxylic acid, 2-methyl,2-methyl-thiazole-4-carboxylic acid,2-methyl-4-thiazolecarboxylicacid,2-methyl-thiazole4-carboxylic acid,4-thiazolecarboxylicacid, 2-methyl,2-methyl-1,3-thiazole-4-carboxylicacid
IUPAC Name 2-methyl-1,3-thiazole-4-carboxylic acid
InChI Key ZHDRDZMTEOIWSX-UHFFFAOYSA-N
Molecular Formula C5H5NO2S
5

Methyle3-amino-5-phenylthiophene-2-carboxylate, 97%, Thermo Scientific™

CAS: 100063-22-7 Molecular Formula: C12H11NO2S Molecular Weight (g/mol): 233.285 MDL Number: MFCD00068161 InChI Key: QESSCNMSOLRYBO-UHFFFAOYSA-N Synonym: methyl 3-amino-5-phenyl-2-thiophenecarboxylate,2-thiophenecarboxylic acid, 3-amino-5-phenyl-, methyl ester,methyl-3-amino-5-phenylthiophene-2-carboxylate,methyl 3-amino-5-4-phenyl thiophene-2-carboxylate,3-amino-5-phenyl-thiophene-2-carboxylic acid methyl ester,maybridge1_003977,acmc-2097mh,methyl-3-amino-5-phenylthiophene-carboxylate,3-amino-2-methoxycarbonyl-5-phenylthiophene,methyl 3-amino-5-phenyl-thiophene-2-carboxylate PubChem CID: 700562 IUPAC Name: methyl 3-amino-5-phenylthiophene-2-carboxylate SMILES: COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)N

PubChem CID 700562
CAS 100063-22-7
Molecular Weight (g/mol) 233.285
MDL Number MFCD00068161
SMILES COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)N
Synonym methyl 3-amino-5-phenyl-2-thiophenecarboxylate,2-thiophenecarboxylic acid, 3-amino-5-phenyl-, methyl ester,methyl-3-amino-5-phenylthiophene-2-carboxylate,methyl 3-amino-5-4-phenyl thiophene-2-carboxylate,3-amino-5-phenyl-thiophene-2-carboxylic acid methyl ester,maybridge1_003977,acmc-2097mh,methyl-3-amino-5-phenylthiophene-carboxylate,3-amino-2-methoxycarbonyl-5-phenylthiophene,methyl 3-amino-5-phenyl-thiophene-2-carboxylate
IUPAC Name methyl 3-amino-5-phenylthiophene-2-carboxylate
InChI Key QESSCNMSOLRYBO-UHFFFAOYSA-N
Molecular Formula C12H11NO2S
6

2-(Chloromethyl)-5-(4-methylphenyl)-1,3,4-oxadiazole, ≥95%, Thermo Scientific™

CAS: 287197-95-9 Molecular Formula: C10H9ClN2O Molecular Weight (g/mol): 208.645 MDL Number: MFCD00662318 InChI Key: JDAULQMOFMANSL-UHFFFAOYSA-N Synonym: 2-chloromethyl-5-4-methylphenyl-1,3,4-oxadiazole,5-chloromethyl-2-4-methylphenyl-1,3,4-oxadiazole,1,3,4-oxadiazole, 2-chloromethyl-5-4-methylphenyl,1,3,4-oxadiazole,2-chloromethyl-5-4-methylphenyl,2-chloromethyl-5-p-tolyl-1,3,4 oxadiazole,2-chloromethyl-5-p-tolyl-1,3,4-oxadiazole,1,3,4 oxadiazole, 2-chloromethyl-5-p-tolyl PubChem CID: 736973 IUPAC Name: 2-(chloromethyl)-5-(4-methylphenyl)-1,3,4-oxadiazole SMILES: CC1=CC=C(C=C1)C2=NN=C(O2)CCl

PubChem CID 736973
CAS 287197-95-9
Molecular Weight (g/mol) 208.645
MDL Number MFCD00662318
SMILES CC1=CC=C(C=C1)C2=NN=C(O2)CCl
Synonym 2-chloromethyl-5-4-methylphenyl-1,3,4-oxadiazole,5-chloromethyl-2-4-methylphenyl-1,3,4-oxadiazole,1,3,4-oxadiazole, 2-chloromethyl-5-4-methylphenyl,1,3,4-oxadiazole,2-chloromethyl-5-4-methylphenyl,2-chloromethyl-5-p-tolyl-1,3,4 oxadiazole,2-chloromethyl-5-p-tolyl-1,3,4-oxadiazole,1,3,4 oxadiazole, 2-chloromethyl-5-p-tolyl
IUPAC Name 2-(chloromethyl)-5-(4-methylphenyl)-1,3,4-oxadiazole
InChI Key JDAULQMOFMANSL-UHFFFAOYSA-N
Molecular Formula C10H9ClN2O
7

2-piperidinobenzamide, 97%, Thermo Scientific™

CAS: 3430-40-8 Molecular Formula: C12H16N2O Molecular Weight (g/mol): 204.27 MDL Number: MFCD00052257 InChI Key: VTXYPPVXMJMLCY-UHFFFAOYSA-N Synonym: 2-piperidinobenzamide,2-piperidin-1-yl benzamide,benzamide,2-1-piperidinyl,2-piperidylbenzamide,piperidinyl benzamide,maybridge1_000974,2-1-piperidinyl benzamide,benzamide, 2-1-piperidinyl PubChem CID: 335067 SMILES: NC(=O)C1=CC=CC=C1N1CCCCC1

PubChem CID 335067
CAS 3430-40-8
Molecular Weight (g/mol) 204.27
MDL Number MFCD00052257
SMILES NC(=O)C1=CC=CC=C1N1CCCCC1
Synonym 2-piperidinobenzamide,2-piperidin-1-yl benzamide,benzamide,2-1-piperidinyl,2-piperidylbenzamide,piperidinyl benzamide,maybridge1_000974,2-1-piperidinyl benzamide,benzamide, 2-1-piperidinyl
InChI Key VTXYPPVXMJMLCY-UHFFFAOYSA-N
Molecular Formula C12H16N2O
8

(1-Ethyl-1H-1,2,4-triazol-5-yl)methanol, 97%, Thermo Scientific™

CAS: 215868-81-8 Molecular Formula: C5H9N3O Molecular Weight (g/mol): 127.15 MDL Number: MFCD09966168 InChI Key: ZQYXCGFXZPLEKX-UHFFFAOYSA-N Synonym: 1-ethyl-1h-1,2,4-triazol-5-yl methanol,2-ethyl-1,2,4-triazol-3-yl methanol,2-ethyl-2h-1,2,4-triazol-3-yl methanol,1h-1,2,4-triazole-5-methanol, 1-ethyl,2-ethyl-2h-1,2,4 triazol-3-yl methanol,1h-1,2,4-triazole-5-methanol,1-ethyl,1-ethyl-5-hydroxymethyl-1,2,4-triazole,1-ethyl-1,2,4-triazol-5-yl methan-1-ol,2-ethyl-2h-1,2,4 triazol-3-yl-methanol PubChem CID: 11412385 SMILES: CCN1N=CN=C1CO

PubChem CID 11412385
CAS 215868-81-8
Molecular Weight (g/mol) 127.15
MDL Number MFCD09966168
SMILES CCN1N=CN=C1CO
Synonym 1-ethyl-1h-1,2,4-triazol-5-yl methanol,2-ethyl-1,2,4-triazol-3-yl methanol,2-ethyl-2h-1,2,4-triazol-3-yl methanol,1h-1,2,4-triazole-5-methanol, 1-ethyl,2-ethyl-2h-1,2,4 triazol-3-yl methanol,1h-1,2,4-triazole-5-methanol,1-ethyl,1-ethyl-5-hydroxymethyl-1,2,4-triazole,1-ethyl-1,2,4-triazol-5-yl methan-1-ol,2-ethyl-2h-1,2,4 triazol-3-yl-methanol
InChI Key ZQYXCGFXZPLEKX-UHFFFAOYSA-N
Molecular Formula C5H9N3O
9

3-[2-Oxo-3-(trifluoromethyl)-1,2-dihydropyridin-1-yl]propanenitrile, 97%, Thermo Scientific™

CAS: 175277-60-8 Molecular Formula: C9H7F3N2O Molecular Weight (g/mol): 216.163 MDL Number: MFCD00204216 InChI Key: CQBBWSPMEJVWQE-UHFFFAOYSA-N Synonym: 3-2-oxo-3-trifluoromethyl pyridin-1 2h-yl propanenitrile,1-2-cyanoethyl-3-trifluoromethyl-2 1h-pyridone,3-2-oxo-3-trifluoromethyl-1,2-dihydropyridin-1-yl propanenitrile,3-2-oxo-3-trifluoromethyl pyridin-1-yl propanenitrile,1-2-cyanoethyl-3-trifluoromethyl pyrid-2 1h-one,1-2-cyanoethyl-3-trifluoromethyl pyrid-2-1h-one,1-2-cyanoethyl-3-trifluoromethyl pyridin-2 1h-one,1-2-cyanoethyl-3-trifluoromethyl-pyrid-2-1h-one,1-2-cyanoethyl-3-trifluoromethyl-2 1h-pyridon,3-2-oxo-3-trifluoromethyl hydropyridyl propanenitrile PubChem CID: 2736731 IUPAC Name: 3-[2-oxo-3-(trifluoromethyl)pyridin-1-yl]propanenitrile SMILES: C1=CN(C(=O)C(=C1)C(F)(F)F)CCC#N

PubChem CID 2736731
CAS 175277-60-8
Molecular Weight (g/mol) 216.163
MDL Number MFCD00204216
SMILES C1=CN(C(=O)C(=C1)C(F)(F)F)CCC#N
Synonym 3-2-oxo-3-trifluoromethyl pyridin-1 2h-yl propanenitrile,1-2-cyanoethyl-3-trifluoromethyl-2 1h-pyridone,3-2-oxo-3-trifluoromethyl-1,2-dihydropyridin-1-yl propanenitrile,3-2-oxo-3-trifluoromethyl pyridin-1-yl propanenitrile,1-2-cyanoethyl-3-trifluoromethyl pyrid-2 1h-one,1-2-cyanoethyl-3-trifluoromethyl pyrid-2-1h-one,1-2-cyanoethyl-3-trifluoromethyl pyridin-2 1h-one,1-2-cyanoethyl-3-trifluoromethyl-pyrid-2-1h-one,1-2-cyanoethyl-3-trifluoromethyl-2 1h-pyridon,3-2-oxo-3-trifluoromethyl hydropyridyl propanenitrile
IUPAC Name 3-[2-oxo-3-(trifluoromethyl)pyridin-1-yl]propanenitrile
InChI Key CQBBWSPMEJVWQE-UHFFFAOYSA-N
Molecular Formula C9H7F3N2O
10

3-Thien-3-ylaniline, ≥97%, Thermo Scientific™

CAS: 161886-96-0 Molecular Formula: C10H9NS Molecular Weight (g/mol): 175.25 MDL Number: MFCD06740169 InChI Key: SHUODWYRFVFGOA-UHFFFAOYSA-N Synonym: 3-thien-3-ylaniline,3-thiophen-3-yl aniline,3-3-aminophenyl thiophene,3-thiophen-3-yl-phenylamine,3-3-thienyl aniline,3-3-thienyl phenylamine,3-thiophen-3-ylphenylamine,benzenamine,3-3-thienyl,3-thiophen-3-yl benzenamine,benzenamine, 3-3-thienyl PubChem CID: 4130337 SMILES: NC1=CC=CC(=C1)C1=CSC=C1

PubChem CID 4130337
CAS 161886-96-0
Molecular Weight (g/mol) 175.25
MDL Number MFCD06740169
SMILES NC1=CC=CC(=C1)C1=CSC=C1
Synonym 3-thien-3-ylaniline,3-thiophen-3-yl aniline,3-3-aminophenyl thiophene,3-thiophen-3-yl-phenylamine,3-3-thienyl aniline,3-3-thienyl phenylamine,3-thiophen-3-ylphenylamine,benzenamine,3-3-thienyl,3-thiophen-3-yl benzenamine,benzenamine, 3-3-thienyl
InChI Key SHUODWYRFVFGOA-UHFFFAOYSA-N
Molecular Formula C10H9NS
11

5-Methyl-4-isoxazolesulfonyl chloride, 95%, Thermo Scientific™

CAS: 321309-26-6 Molecular Formula: C4H4ClNO3S Molecular Weight (g/mol): 181.59 MDL Number: MFCD02681975 InChI Key: STYUNYVEEFPQMF-UHFFFAOYSA-N Synonym: 5-methyl-4-isoxazolesulfonyl chloride,5-methylisoxazole-4-sulfonyl chloride,4-isoxazolesulfonyl chloride, 5-methyl,4-chlorosulfonyl-5-methylisoxazole,chloro 5-methylisoxazol-4-yl sulfone,4-chlorosulphonyl-5-methylisoxazole,4-isoxazolesulfonylchloride, 5-methyl,5-methyl-4-isoxazole sulfonyl chloride,5-methyl-isoxazole-4-sulfonyl chloride,5-methylisoxazole-4-sulphonyl chloride PubChem CID: 2776141 IUPAC Name: 5-methyl-1,2-oxazole-4-sulfonyl chloride SMILES: CC1=C(C=NO1)S(=O)(=O)Cl

PubChem CID 2776141
CAS 321309-26-6
Molecular Weight (g/mol) 181.59
MDL Number MFCD02681975
SMILES CC1=C(C=NO1)S(=O)(=O)Cl
Synonym 5-methyl-4-isoxazolesulfonyl chloride,5-methylisoxazole-4-sulfonyl chloride,4-isoxazolesulfonyl chloride, 5-methyl,4-chlorosulfonyl-5-methylisoxazole,chloro 5-methylisoxazol-4-yl sulfone,4-chlorosulphonyl-5-methylisoxazole,4-isoxazolesulfonylchloride, 5-methyl,5-methyl-4-isoxazole sulfonyl chloride,5-methyl-isoxazole-4-sulfonyl chloride,5-methylisoxazole-4-sulphonyl chloride
IUPAC Name 5-methyl-1,2-oxazole-4-sulfonyl chloride
InChI Key STYUNYVEEFPQMF-UHFFFAOYSA-N
Molecular Formula C4H4ClNO3S
12

Benzo[b]thiophene-2-carbohydrazide, 97%, Thermo Scientific™

CAS: 175135-07-6 Molecular Formula: C9H8N2OS Molecular Weight (g/mol): 192.24 MDL Number: MFCD00052501 InChI Key: ZXKPFIRPUUAAPQ-UHFFFAOYSA-N Synonym: benzo b thiophene-2-carbohydrazide,benzo b thiophene-2-carboxylic hydrazide,thianaphthene-2-carboxylic hydrazide,benzo b thiophene-2-carboxylicacid, hydrazide,maybridge1_008989,acmc-1c3go,#,benzo b thiophene-2-carboxylic acid hydrazide PubChem CID: 519437 IUPAC Name: 1-benzothiophene-2-carbohydrazide SMILES: NNC(=O)C1=CC2=CC=CC=C2S1

PubChem CID 519437
CAS 175135-07-6
Molecular Weight (g/mol) 192.24
MDL Number MFCD00052501
SMILES NNC(=O)C1=CC2=CC=CC=C2S1
Synonym benzo b thiophene-2-carbohydrazide,benzo b thiophene-2-carboxylic hydrazide,thianaphthene-2-carboxylic hydrazide,benzo b thiophene-2-carboxylicacid, hydrazide,maybridge1_008989,acmc-1c3go,#,benzo b thiophene-2-carboxylic acid hydrazide
IUPAC Name 1-benzothiophene-2-carbohydrazide
InChI Key ZXKPFIRPUUAAPQ-UHFFFAOYSA-N
Molecular Formula C9H8N2OS
13

3-Bromo-2-furoic acid, 97%, Thermo Scientific™

CAS: 14903-90-3 Molecular Formula: C5H3BrO3 Molecular Weight (g/mol): 190.98 MDL Number: MFCD00092761 InChI Key: UZBGSJZFBUOJNE-UHFFFAOYSA-N PubChem CID: 605479 IUPAC Name: 3-bromofuran-2-carboxylic acid SMILES: C1=COC(=C1Br)C(=O)O

PubChem CID 605479
CAS 14903-90-3
Molecular Weight (g/mol) 190.98
MDL Number MFCD00092761
SMILES C1=COC(=C1Br)C(=O)O
IUPAC Name 3-bromofuran-2-carboxylic acid
InChI Key UZBGSJZFBUOJNE-UHFFFAOYSA-N
Molecular Formula C5H3BrO3
14

5-Methyl-2-(trifluoromethyl)-3-furoic acid, 97%, Thermo Scientific™

CAS: 17515-74-1 Molecular Formula: C7H5F3O3 Molecular Weight (g/mol): 194.11 MDL Number: MFCD00275563 InChI Key: NURNFMNHTHXTDS-UHFFFAOYSA-N PubChem CID: 2782183 IUPAC Name: 5-methyl-2-(trifluoromethyl)furan-3-carboxylic acid SMILES: CC1=CC(C(O)=O)=C(O1)C(F)(F)F

PubChem CID 2782183
CAS 17515-74-1
Molecular Weight (g/mol) 194.11
MDL Number MFCD00275563
SMILES CC1=CC(C(O)=O)=C(O1)C(F)(F)F
IUPAC Name 5-methyl-2-(trifluoromethyl)furan-3-carboxylic acid
InChI Key NURNFMNHTHXTDS-UHFFFAOYSA-N
Molecular Formula C7H5F3O3
15

Thieno[2,3-b]pyridin-2-ylmethanol, 97%, Thermo Scientific™

CAS: 131337-81-0 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD07772792 InChI Key: XLUKSWZEEAGBDH-UHFFFAOYSA-N Synonym: thieno 2,3-b pyridin-2-ylmethanol,thieno 2,3-b pyridine-2-methanol,thieno 2,3-b pyridin-2-yl methanol,acmc-1bz5x,thieno 2,3-b pyridine-2-ylmethanol,2-hydroxymethylthieno 2,3-b pyridine,thiopheno 2,3-b pyridin-2-ylmethan-1-ol PubChem CID: 7162092 IUPAC Name: thieno[2,3-b]pyridin-2-ylmethanol SMILES: C1=CC2=C(N=C1)SC(=C2)CO

PubChem CID 7162092
CAS 131337-81-0
Molecular Weight (g/mol) 165.21
MDL Number MFCD07772792
SMILES C1=CC2=C(N=C1)SC(=C2)CO
Synonym thieno 2,3-b pyridin-2-ylmethanol,thieno 2,3-b pyridine-2-methanol,thieno 2,3-b pyridin-2-yl methanol,acmc-1bz5x,thieno 2,3-b pyridine-2-ylmethanol,2-hydroxymethylthieno 2,3-b pyridine,thiopheno 2,3-b pyridin-2-ylmethan-1-ol
IUPAC Name thieno[2,3-b]pyridin-2-ylmethanol
InChI Key XLUKSWZEEAGBDH-UHFFFAOYSA-N
Molecular Formula C8H7NOS