Heteroaromatic compounds

Organic compounds that contain one or more heterocycles that are aromatic; heterocycles are rings that contain atoms from two or more types of elements.

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Melamine, 99%

CAS: 108-78-1 Molecular Formula: C3H6N6 Molecular Weight (g/mol): 126.12 MDL Number: MFCD00006055 InChI Key: JDSHMPZPIAZGSV-UHFFFAOYSA-N Synonym: melamine,cyanurotriamide,cyanuramide,cyanurotriamine,isomelamine,theoharn,teoharn,triaminotriazine,cyanuric triamide,hicophor pr PubChem CID: 7955 ChEBI: CHEBI:27915 IUPAC Name: 1,3,5-triazine-2,4,6-triamine SMILES: NC1=NC(N)=NC(N)=N1

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PubChem CID	7955
CAS	108-78-1
Molecular Weight (g/mol)	126.12
ChEBI	CHEBI:27915
MDL Number	MFCD00006055
SMILES	NC1=NC(N)=NC(N)=N1
Synonym	melamine,cyanurotriamide,cyanuramide,cyanurotriamine,isomelamine,theoharn,teoharn,triaminotriazine,cyanuric triamide,hicophor pr
IUPAC Name	1,3,5-triazine-2,4,6-triamine
InChI Key	JDSHMPZPIAZGSV-UHFFFAOYSA-N
Molecular Formula	C3H6N6

Benzimidazole, 99%

CAS: 51-17-2 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 MDL Number: MFCD00005585 InChI Key: HYZJCKYKOHLVJF-UHFFFAOYSA-N Synonym: benzimidazole,1h-benzo d imidazole,1,3-benzodiazole,benzoimidazole,o-benzimidazole,3-azaindole,benziminazole,benzoglyoxaline,azindole,1,3-diazaindene PubChem CID: 5798 ChEBI: CHEBI:41275 SMILES: N1C=NC2=CC=CC=C12

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PubChem CID	5798
CAS	51-17-2
Molecular Weight (g/mol)	118.14
ChEBI	CHEBI:41275
MDL Number	MFCD00005585
SMILES	N1C=NC2=CC=CC=C12
Synonym	benzimidazole,1h-benzo d imidazole,1,3-benzodiazole,benzoimidazole,o-benzimidazole,3-azaindole,benziminazole,benzoglyoxaline,azindole,1,3-diazaindene
InChI Key	HYZJCKYKOHLVJF-UHFFFAOYSA-N
Molecular Formula	C7H6N2

2,4,6-Tri(2-pyridyl)-1,3,5-triazine, 98%

CAS: 3682-35-7 Molecular Formula: C18H12N6 Molecular Weight (g/mol): 312.34 MDL Number: MFCD00006045 InChI Key: KMVWNDHKTPHDMT-UHFFFAOYSA-N Synonym: 2,4,6-tripyridyl-s-triazine,2,4,6-tris 2-pyridyl-s-triazine,2,4,6-tri 2-pyridyl-1,3,5-triazine,terpyridyl-s-triazine,2,4,6-tri 2-pyridyl-s-triazine,tptz iron reagent,1,3,5-triazine, 2,4,6-tri-2-pyridinyl,tri-2-pyridyl-s-triazine,s-triazine, tri-2-pyridyl,2,4,6-tris 2-pyridyl-1,3,5-triazine PubChem CID: 77258 SMILES: C1=CC=C(N=C1)C1=NC(=NC(=N1)C1=CC=CC=N1)C1=CC=CC=N1

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PubChem CID	77258
CAS	3682-35-7
Molecular Weight (g/mol)	312.34
MDL Number	MFCD00006045
SMILES	C1=CC=C(N=C1)C1=NC(=NC(=N1)C1=CC=CC=N1)C1=CC=CC=N1
Synonym	2,4,6-tripyridyl-s-triazine,2,4,6-tris 2-pyridyl-s-triazine,2,4,6-tri 2-pyridyl-1,3,5-triazine,terpyridyl-s-triazine,2,4,6-tri 2-pyridyl-s-triazine,tptz iron reagent,1,3,5-triazine, 2,4,6-tri-2-pyridinyl,tri-2-pyridyl-s-triazine,s-triazine, tri-2-pyridyl,2,4,6-tris 2-pyridyl-1,3,5-triazine
InChI Key	KMVWNDHKTPHDMT-UHFFFAOYSA-N
Molecular Formula	C18H12N6

(Z,Z)-Alpha-Furil Dioxime, TRC

CAS: 23789-34-6 Molecular Formula: C10H8N2O4 Molecular Weight (g/mol): 220.18 SMILES: O\N=C(\C(=N\O)\c1occc1)/c2occc2

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CAS	23789-34-6
Molecular Weight (g/mol)	220.18
SMILES	O\N=C(\C(=N\O)\c1occc1)/c2occc2
Molecular Formula	C10H8N2O4

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Imidazole, 99%

CAS: 288-32-4 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005183 InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N Synonym: imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole PubChem CID: 795 ChEBI: CHEBI:16069 IUPAC Name: 1H-imidazole SMILES: N1C=CN=C1

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PubChem CID	795
CAS	288-32-4
Molecular Weight (g/mol)	68.08
ChEBI	CHEBI:16069
MDL Number	MFCD00005183
SMILES	N1C=CN=C1
Synonym	imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole
IUPAC Name	1H-imidazole
InChI Key	RAXXELZNTBOGNW-UHFFFAOYSA-N
Molecular Formula	C3H4N2

2-Cyanopyridine, 99%

CAS: 100-70-9 Molecular Formula: C6H4N2 Molecular Weight (g/mol): 104.112 MDL Number: MFCD00006218 InChI Key: FFNVQNRYTPFDDP-UHFFFAOYSA-N Synonym: 2-cyanopyridine,picolinonitrile,2-pyridinecarbonitrile,pyridinecarbonitrile,2-pyridyl nitrile,picolinic acid nitrile,cyanopyridine,unii-whr1dpg7ys,2-pyridinecarboxylic acid, nitrile,2-cyano pyridine PubChem CID: 7522 ChEBI: CHEBI:27837 IUPAC Name: pyridine-2-carbonitrile SMILES: C1=CC=NC(=C1)C#N

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PubChem CID	7522
CAS	100-70-9
Molecular Weight (g/mol)	104.112
ChEBI	CHEBI:27837
MDL Number	MFCD00006218
SMILES	C1=CC=NC(=C1)C#N
Synonym	2-cyanopyridine,picolinonitrile,2-pyridinecarbonitrile,pyridinecarbonitrile,2-pyridyl nitrile,picolinic acid nitrile,cyanopyridine,unii-whr1dpg7ys,2-pyridinecarboxylic acid, nitrile,2-cyano pyridine
IUPAC Name	pyridine-2-carbonitrile
InChI Key	FFNVQNRYTPFDDP-UHFFFAOYSA-N
Molecular Formula	C6H4N2

Sulfur trioxide-pyridine complex, 98%, active SO3 ca 48-50%

CAS: 26412-87-3 Molecular Formula: C5H5NO3S Molecular Weight (g/mol): 159.16 MDL Number: MFCD00012437 InChI Key: UDYFLDICVHJSOY-UHFFFAOYSA-N Synonym: pyridine sulfur trioxide,sulfur trioxide pyridine complex,pyridine; sulfur trioxide,pyridine sulfotrioxide,pyridine compound with sulfur trioxide 1:1,sulfur trioxide, compd. with pyridine,pyridine-sulfur trioxide complex,active sulfure trioxide,sulfur trioxide-pyridine,pyridine-sulfur trioxide PubChem CID: 168533 SMILES: O=S(=O)=O.C1=CC=NC=C1

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PubChem CID	168533
CAS	26412-87-3
Molecular Weight (g/mol)	159.16
MDL Number	MFCD00012437
SMILES	O=S(=O)=O.C1=CC=NC=C1
Synonym	pyridine sulfur trioxide,sulfur trioxide pyridine complex,pyridine; sulfur trioxide,pyridine sulfotrioxide,pyridine compound with sulfur trioxide 1:1,sulfur trioxide, compd. with pyridine,pyridine-sulfur trioxide complex,active sulfure trioxide,sulfur trioxide-pyridine,pyridine-sulfur trioxide
InChI Key	UDYFLDICVHJSOY-UHFFFAOYSA-N
Molecular Formula	C5H5NO3S

Hydrogen fluoride pyridine complex, ca 70% HF, Thermo Scientific Chemicals

CAS: 62778-11-4 Molecular Formula: C5H6FN Molecular Weight (g/mol): 99.108 MDL Number: MFCD00012436 InChI Key: GRJJQCWNZGRKAU-UHFFFAOYSA-N Synonym: pyridine hydrofluoride,hydrogen fluoride-pyridine,olah's reagent,pyridinium fluoride,hydrogen fluoride pyridine complex,hydrogen fluoride pyridine,hf-pyridine,pyridine, hydrofluoride 1:1,pyridinium poly hydrogen fluoride,hydrogen fluoride/pyridine PubChem CID: 64774 IUPAC Name: pyridine;hydrofluoride SMILES: C1=CC=NC=C1.F

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PubChem CID	64774
CAS	62778-11-4
Molecular Weight (g/mol)	99.108
MDL Number	MFCD00012436
SMILES	C1=CC=NC=C1.F
Synonym	pyridine hydrofluoride,hydrogen fluoride-pyridine,olah's reagent,pyridinium fluoride,hydrogen fluoride pyridine complex,hydrogen fluoride pyridine,hf-pyridine,pyridine, hydrofluoride 1:1,pyridinium poly hydrogen fluoride,hydrogen fluoride/pyridine
IUPAC Name	pyridine;hydrofluoride
InChI Key	GRJJQCWNZGRKAU-UHFFFAOYSA-N
Molecular Formula	C5H6FN

Benzoguanamine, 99%

CAS: 91-76-9 Molecular Formula: C9H9N5 Molecular Weight (g/mol): 187.21 MDL Number: MFCD00023187 InChI Key: GZVHEAJQGPRDLQ-UHFFFAOYSA-N Synonym: benzoguanamine,2,4-diamino-6-phenyl-1,3,5-triazine,benzoguanimine,1,3,5-triazine-2,4-diamine, 6-phenyl,usaf rh-5,2,4-diamino-6-phenyl-s-triazine,2-phenyl-4,6-diamino-s-triazine,4,6-diamino-2-phenyl-s-triazine,benzoguanamine van,s-triazine, 2,4-diamino-6-phenyl PubChem CID: 7064 IUPAC Name: 6-phenyl-1,3,5-triazine-2,4-diamine SMILES: NC1=NC(=NC(N)=N1)C1=CC=CC=C1

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PubChem CID	7064
CAS	91-76-9
Molecular Weight (g/mol)	187.21
MDL Number	MFCD00023187
SMILES	NC1=NC(=NC(N)=N1)C1=CC=CC=C1
Synonym	benzoguanamine,2,4-diamino-6-phenyl-1,3,5-triazine,benzoguanimine,1,3,5-triazine-2,4-diamine, 6-phenyl,usaf rh-5,2,4-diamino-6-phenyl-s-triazine,2-phenyl-4,6-diamino-s-triazine,4,6-diamino-2-phenyl-s-triazine,benzoguanamine van,s-triazine, 2,4-diamino-6-phenyl
IUPAC Name	6-phenyl-1,3,5-triazine-2,4-diamine
InChI Key	GZVHEAJQGPRDLQ-UHFFFAOYSA-N
Molecular Formula	C9H9N5

3,6-Di-2-pyridyl-1,2,4,5-tetrazine, 96%

CAS: 1671-87-0 Molecular Formula: C12H8N6 Molecular Weight (g/mol): 236.24 MDL Number: MFCD00121717 InChI Key: JFBIRMIEJBPDTQ-UHFFFAOYSA-N Synonym: 3,6-di pyridin-2-yl-1,2,4,5-tetrazine,3,6-di 2-pyridyl-1,2,4,5-tetrazine,3,6-di-2-pyridyl-1,2,4,5-tetrazine,3,6-di-2-pyridinyl-1,2,4,5-tetrazine,3,6-bis 2-pyridyl-1,2,4,5-tetrazine,bis pyridin-2-yl-1,2,4,5-tetrazine,3,6-bis 2-pyridinyl-1,2,4,5-tetrazine,bptz,acmc-209dvt,3,6-di-2-pyridyl-s-tetrazine PubChem CID: 315109 IUPAC Name: 3,6-dipyridin-2-yl-1,2,4,5-tetrazine SMILES: C1=CC=C(N=C1)C1=NN=C(N=N1)C1=CC=CC=N1

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PubChem CID	315109
CAS	1671-87-0
Molecular Weight (g/mol)	236.24
MDL Number	MFCD00121717
SMILES	C1=CC=C(N=C1)C1=NN=C(N=N1)C1=CC=CC=N1
Synonym	3,6-di pyridin-2-yl-1,2,4,5-tetrazine,3,6-di 2-pyridyl-1,2,4,5-tetrazine,3,6-di-2-pyridyl-1,2,4,5-tetrazine,3,6-di-2-pyridinyl-1,2,4,5-tetrazine,3,6-bis 2-pyridyl-1,2,4,5-tetrazine,bis pyridin-2-yl-1,2,4,5-tetrazine,3,6-bis 2-pyridinyl-1,2,4,5-tetrazine,bptz,acmc-209dvt,3,6-di-2-pyridyl-s-tetrazine
IUPAC Name	3,6-dipyridin-2-yl-1,2,4,5-tetrazine
InChI Key	JFBIRMIEJBPDTQ-UHFFFAOYSA-N
Molecular Formula	C12H8N6

Pyridinium p-toluenesulfonate, 98+%

CAS: 24057-28-1 Molecular Formula: C₁₂H₁₃NO₃S MDL Number: MFCD00013108 Synonym: pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt

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CAS	24057-28-1
MDL Number	MFCD00013108
Synonym	pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt
Molecular Formula	C₁₂H₁₃NO₃S

Phenazine, 99+%

CAS: 92-82-0 Molecular Formula: C12H8N2 Molecular Weight (g/mol): 180.21 MDL Number: MFCD00005023 InChI Key: PCNDJXKNXGMECE-UHFFFAOYSA-N Synonym: dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs PubChem CID: 4757 ChEBI: CHEBI:36674 IUPAC Name: phenazine SMILES: C1=CC=C2C(=C1)N=C3C=CC=CC3=N2

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PubChem CID	4757
CAS	92-82-0
Molecular Weight (g/mol)	180.21
ChEBI	CHEBI:36674
MDL Number	MFCD00005023
SMILES	C1=CC=C2C(=C1)N=C3C=CC=CC3=N2
Synonym	dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs
IUPAC Name	phenazine
InChI Key	PCNDJXKNXGMECE-UHFFFAOYSA-N
Molecular Formula	C12H8N2

Quinoline, 98%

CAS: 91-22-5 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.16 MDL Number: MFCD00006736,MFCD06637409,MFCD31699982,MFCD31699983,MFCD31699984,MFCD31699985,MFCD31699986,MFCD31699987 InChI Key: SMWDFEZZVXVKRB-UHFFFAOYSA-N Synonym: chinolin,chinoline,1-benzazine,quinolin,1-azanaphthalene,chinoleine,leucol,benzo b pyridine,benzopyridine,leukol PubChem CID: 7047 ChEBI: CHEBI:17362 IUPAC Name: quinoline SMILES: C1=CC=C2N=CC=CC2=C1

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PubChem CID	7047
CAS	91-22-5
Molecular Weight (g/mol)	129.16
ChEBI	CHEBI:17362
MDL Number	MFCD00006736,MFCD06637409,MFCD31699982,MFCD31699983,MFCD31699984,MFCD31699985,MFCD31699986,MFCD31699987
SMILES	C1=CC=C2N=CC=CC2=C1
Synonym	chinolin,chinoline,1-benzazine,quinolin,1-azanaphthalene,chinoleine,leucol,benzo b pyridine,benzopyridine,leukol
IUPAC Name	quinoline
InChI Key	SMWDFEZZVXVKRB-UHFFFAOYSA-N
Molecular Formula	C9H7N

2,6-Di-tert-butylpyridine, 97+%

CAS: 585-48-8 Molecular Formula: C13H21N Molecular Weight (g/mol): 191.318 MDL Number: MFCD00006306 InChI Key: UWKQJZCTQGMHKD-UHFFFAOYSA-N Synonym: 2,6-di-tert-butylpyridine,2,6-di tert-butyl pyridine,2,6-di-t-butylpyridine,unii-oi9lf0h4mm,2,6-di-t-butyl pyridine,pyridine, 2,6-bis 1,1-dimethylethyl,oi9lf0h4mm,2,6-di-tert-butyl pyridine,pyridine, 2,6-di-tert-butyl,pubchem16119 PubChem CID: 68510 IUPAC Name: 2,6-ditert-butylpyridine SMILES: CC(C)(C)C1=NC(=CC=C1)C(C)(C)C

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PubChem CID	68510
CAS	585-48-8
Molecular Weight (g/mol)	191.318
MDL Number	MFCD00006306
SMILES	CC(C)(C)C1=NC(=CC=C1)C(C)(C)C
Synonym	2,6-di-tert-butylpyridine,2,6-di tert-butyl pyridine,2,6-di-t-butylpyridine,unii-oi9lf0h4mm,2,6-di-t-butyl pyridine,pyridine, 2,6-bis 1,1-dimethylethyl,oi9lf0h4mm,2,6-di-tert-butyl pyridine,pyridine, 2,6-di-tert-butyl,pubchem16119
IUPAC Name	2,6-ditert-butylpyridine
InChI Key	UWKQJZCTQGMHKD-UHFFFAOYSA-N
Molecular Formula	C13H21N

2-Mercaptobenzothiazole, 97%

CAS: 149-30-4 Molecular Formula: C7H5NS2 Molecular Weight (g/mol): 167.244 MDL Number: MFCD00005781 InChI Key: YXIWHUQXZSMYRE-UHFFFAOYSA-N Synonym: 2-mercaptobenzothiazole,2-benzothiazolethiol,captax,benzothiazolethiol,2 3h-benzothiazolethione,benzothiazole-2-thiol,1,3-benzothiazole-2-thiol,benzo d thiazole-2-thiol,rokon,rotax PubChem CID: 697993 ChEBI: CHEBI:34292 IUPAC Name: 3H-1,3-benzothiazole-2-thione SMILES: C1=CC=C2C(=C1)NC(=S)S2

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PubChem CID	697993
CAS	149-30-4
Molecular Weight (g/mol)	167.244
ChEBI	CHEBI:34292
MDL Number	MFCD00005781
SMILES	C1=CC=C2C(=C1)NC(=S)S2
Synonym	2-mercaptobenzothiazole,2-benzothiazolethiol,captax,benzothiazolethiol,2 3h-benzothiazolethione,benzothiazole-2-thiol,1,3-benzothiazole-2-thiol,benzo d thiazole-2-thiol,rokon,rotax
IUPAC Name	3H-1,3-benzothiazole-2-thione
InChI Key	YXIWHUQXZSMYRE-UHFFFAOYSA-N
Molecular Formula	C7H5NS2

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