Heteroaromatic compounds
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Filtered Search Results
1,2-Benzisothiazol-3(2H)-one 98.0+%, TCI America™
CAS: 2634-33-5 Molecular Formula: C7H5NOS Molecular Weight (g/mol): 151.183 MDL Number: MFCD00127753 InChI Key: DMSMPAJRVJJAGA-UHFFFAOYSA-N Synonym: 1,2-benzisothiazol-3 2h-one,1,2-benzisothiazolin-3-one,benzisothiazolone,proxel,benzo d isothiazol-3 2h-one,1,2-benzisothiazoline-3-one,benzisothiazolinone,proxel pl,benzo d isothiazol-3-one,2,3-dihydro-1,2-benzothiazol-3-one PubChem CID: 17520 ChEBI: CHEBI:167099 IUPAC Name: 1,2-benzothiazol-3-one SMILES: C1=CC=C2C(=C1)C(=O)NS2
| PubChem CID | 17520 |
|---|---|
| CAS | 2634-33-5 |
| Molecular Weight (g/mol) | 151.183 |
| ChEBI | CHEBI:167099 |
| MDL Number | MFCD00127753 |
| SMILES | C1=CC=C2C(=C1)C(=O)NS2 |
| Synonym | 1,2-benzisothiazol-3 2h-one,1,2-benzisothiazolin-3-one,benzisothiazolone,proxel,benzo d isothiazol-3 2h-one,1,2-benzisothiazoline-3-one,benzisothiazolinone,proxel pl,benzo d isothiazol-3-one,2,3-dihydro-1,2-benzothiazol-3-one |
| IUPAC Name | 1,2-benzothiazol-3-one |
| InChI Key | DMSMPAJRVJJAGA-UHFFFAOYSA-N |
| Molecular Formula | C7H5NOS |
Purine, 99%
CAS: 120-73-0 MDL Number: MFCD00079221 InChI Key: KDCGOANMDULRCW-UHFFFAOYSA-N Synonym: purine,9h-purine,1h-purine,isopurine,beta-purine,7h-imidazo 4,5-d pyrimidine,imidazo 4,5-d pyrimidine,3,5,7-triazaindole,9h-purine van,3h-purine PubChem CID: 1044 ChEBI: CHEBI:17258 IUPAC Name: 7H-purine SMILES: C1=C2C(=NC=N1)N=CN2
| PubChem CID | 1044 |
|---|---|
| CAS | 120-73-0 |
| ChEBI | CHEBI:17258 |
| MDL Number | MFCD00079221 |
| SMILES | C1=C2C(=NC=N1)N=CN2 |
| Synonym | purine,9h-purine,1h-purine,isopurine,beta-purine,7h-imidazo 4,5-d pyrimidine,imidazo 4,5-d pyrimidine,3,5,7-triazaindole,9h-purine van,3h-purine |
| IUPAC Name | 7H-purine |
| InChI Key | KDCGOANMDULRCW-UHFFFAOYSA-N |
Thiabendazole, 98+%
CAS: 148-79-8 Molecular Formula: C10H7N3S Molecular Weight (g/mol): 201.247 MDL Number: MFCD00005587 InChI Key: WJCNZQLZVWNLKY-UHFFFAOYSA-N Synonym: thiabendazole,tiabendazole,mintezol,equizole,tiabendazol,mintesol,omnizole,thibenzole,thiabendazol,bovizole PubChem CID: 5430 ChEBI: CHEBI:45979 IUPAC Name: 4-(1H-benzimidazol-2-yl)-1,3-thiazole SMILES: C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3
| PubChem CID | 5430 |
|---|---|
| CAS | 148-79-8 |
| Molecular Weight (g/mol) | 201.247 |
| ChEBI | CHEBI:45979 |
| MDL Number | MFCD00005587 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3 |
| Synonym | thiabendazole,tiabendazole,mintezol,equizole,tiabendazol,mintesol,omnizole,thibenzole,thiabendazol,bovizole |
| IUPAC Name | 4-(1H-benzimidazol-2-yl)-1,3-thiazole |
| InChI Key | WJCNZQLZVWNLKY-UHFFFAOYSA-N |
| Molecular Formula | C10H7N3S |
2-Methylthiophene, 98%
CAS: 554-14-3 Molecular Formula: C5H6S Molecular Weight (g/mol): 98.16 MDL Number: MFCD00005451 InChI Key: XQQBUAPQHNYYRS-UHFFFAOYSA-N Synonym: thiophene, 2-methyl,2-methyl thiophene,thiophene, methyl,alpha-methylthiophene,ccris 2936,2-methyl-thiophene,unii-7115jap77a,2-methylthiacyclopentadiene,a-thiotolene,pubchem5204 PubChem CID: 11126 IUPAC Name: 2-methylthiophene SMILES: CC1=CC=CS1
| PubChem CID | 11126 |
|---|---|
| CAS | 554-14-3 |
| Molecular Weight (g/mol) | 98.16 |
| MDL Number | MFCD00005451 |
| SMILES | CC1=CC=CS1 |
| Synonym | thiophene, 2-methyl,2-methyl thiophene,thiophene, methyl,alpha-methylthiophene,ccris 2936,2-methyl-thiophene,unii-7115jap77a,2-methylthiacyclopentadiene,a-thiotolene,pubchem5204 |
| IUPAC Name | 2-methylthiophene |
| InChI Key | XQQBUAPQHNYYRS-UHFFFAOYSA-N |
| Molecular Formula | C5H6S |
3-Methylindole 98.0+%, TCI America™
CAS: 83-34-1 Molecular Formula: C9H9N Molecular Weight (g/mol): 131.178 MDL Number: MFCD00005627 InChI Key: ZFRKQXVRDFCRJG-UHFFFAOYSA-N Synonym: 3-methylindole,skatole,scatole,skatol,1h-indole, 3-methyl,beta-methylindole,indole, 3-methyl,3-mi,3-methyl-4,5-benzopyrrole,3-methyl indole PubChem CID: 6736 ChEBI: CHEBI:9171 IUPAC Name: 3-methyl-1H-indole SMILES: CC1=CNC2=CC=CC=C12
| PubChem CID | 6736 |
|---|---|
| CAS | 83-34-1 |
| Molecular Weight (g/mol) | 131.178 |
| ChEBI | CHEBI:9171 |
| MDL Number | MFCD00005627 |
| SMILES | CC1=CNC2=CC=CC=C12 |
| Synonym | 3-methylindole,skatole,scatole,skatol,1h-indole, 3-methyl,beta-methylindole,indole, 3-methyl,3-mi,3-methyl-4,5-benzopyrrole,3-methyl indole |
| IUPAC Name | 3-methyl-1H-indole |
| InChI Key | ZFRKQXVRDFCRJG-UHFFFAOYSA-N |
| Molecular Formula | C9H9N |
2-Methylindole 99.0+%, TCI America™
CAS: 95-20-5 Molecular Formula: C9H9N Molecular Weight (g/mol): 131.178 MDL Number: MFCD00005616 InChI Key: BHNHHSOHWZKFOX-UHFFFAOYSA-N Synonym: 2-methylindole,1h-indole, 2-methyl,indole, 2-methyl,2-methyl indole,unii-i7cn58827i,2-methylindol,methylketole,methyl indole,2-methyl-indole,pubchem7504 PubChem CID: 7224 ChEBI: CHEBI:49402 IUPAC Name: 2-methyl-1H-indole SMILES: CC1=CC2=CC=CC=C2N1
| PubChem CID | 7224 |
|---|---|
| CAS | 95-20-5 |
| Molecular Weight (g/mol) | 131.178 |
| ChEBI | CHEBI:49402 |
| MDL Number | MFCD00005616 |
| SMILES | CC1=CC2=CC=CC=C2N1 |
| Synonym | 2-methylindole,1h-indole, 2-methyl,indole, 2-methyl,2-methyl indole,unii-i7cn58827i,2-methylindol,methylketole,methyl indole,2-methyl-indole,pubchem7504 |
| IUPAC Name | 2-methyl-1H-indole |
| InChI Key | BHNHHSOHWZKFOX-UHFFFAOYSA-N |
| Molecular Formula | C9H9N |
4,5-Dicyanoimidazole, 99%
CAS: 1122-28-7 Molecular Formula: C5H2N4 Molecular Weight (g/mol): 118.10 MDL Number: MFCD00005194 InChI Key: XGDRLCRGKUCBQL-UHFFFAOYSA-N PubChem CID: 70729 IUPAC Name: 1H-imidazole-4,5-dicarbonitrile SMILES: N#CC1=C(N=CN1)C#N
| PubChem CID | 70729 |
|---|---|
| CAS | 1122-28-7 |
| Molecular Weight (g/mol) | 118.10 |
| MDL Number | MFCD00005194 |
| SMILES | N#CC1=C(N=CN1)C#N |
| IUPAC Name | 1H-imidazole-4,5-dicarbonitrile |
| InChI Key | XGDRLCRGKUCBQL-UHFFFAOYSA-N |
| Molecular Formula | C5H2N4 |
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
| 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 |
2,5-Dimethylpyrazine, 99%
CAS: 123-32-0 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.144 MDL Number: MFCD00006147 InChI Key: LCZUOKDVTBMCMX-UHFFFAOYSA-N Synonym: 2,5-dimethyl pyrazine,pyrazine, 2,5-dimethyl,2,5-dimethylpiazine,2,5-dimethyl-1,4-diazine,2,5-dimethylparadiazine,2,5-dimethyl-pyrazine,unii-v99y0muy1q,fema no. 3272,ccris 2929,natural PubChem CID: 31252 IUPAC Name: 2,5-dimethylpyrazine SMILES: CC1=CN=C(C=N1)C
| PubChem CID | 31252 |
|---|---|
| CAS | 123-32-0 |
| Molecular Weight (g/mol) | 108.144 |
| MDL Number | MFCD00006147 |
| SMILES | CC1=CN=C(C=N1)C |
| Synonym | 2,5-dimethyl pyrazine,pyrazine, 2,5-dimethyl,2,5-dimethylpiazine,2,5-dimethyl-1,4-diazine,2,5-dimethylparadiazine,2,5-dimethyl-pyrazine,unii-v99y0muy1q,fema no. 3272,ccris 2929,natural |
| IUPAC Name | 2,5-dimethylpyrazine |
| InChI Key | LCZUOKDVTBMCMX-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2 |
Pyrazine, 99+% (dry wt.) water <1.0%
CAS: 290-37-9 Molecular Formula: C4H4N2 Molecular Weight (g/mol): 80.09 MDL Number: MFCD00006122 InChI Key: KYQCOXFCLRTKLS-UHFFFAOYSA-N Synonym: 1,4-diazine,p-diazine,paradiazine,piazine,1,4-diazabenzene,pyrazin,ccris 1331,1,4-diazin,mixture,mu-pyrazine; PubChem CID: 9261 ChEBI: CHEBI:30953 IUPAC Name: pyrazine SMILES: C1=CN=CC=N1
| PubChem CID | 9261 |
|---|---|
| CAS | 290-37-9 |
| Molecular Weight (g/mol) | 80.09 |
| ChEBI | CHEBI:30953 |
| MDL Number | MFCD00006122 |
| SMILES | C1=CN=CC=N1 |
| Synonym | 1,4-diazine,p-diazine,paradiazine,piazine,1,4-diazabenzene,pyrazin,ccris 1331,1,4-diazin,mixture,mu-pyrazine; |
| IUPAC Name | pyrazine |
| InChI Key | KYQCOXFCLRTKLS-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2 |
2-Thiopheneacetic acid, 98%
CAS: 1918-77-0 Molecular Formula: C6H6O2S Molecular Weight (g/mol): 142.172 MDL Number: MFCD00005458 InChI Key: SMJRBWINMFUUDS-UHFFFAOYSA-N Synonym: 2-thiopheneacetic acid,2-thienylacetic acid,thiopheneacetic acid,2-thiophen-2-yl acetic acid,thiophene-2-acetic acid,2-2-thienyl acetic acid,2-thiophene acetic acid,thiophen-2-ylacetic acid,thien-2-yl acetic acid,2-carboxymethyl thiophene PubChem CID: 15970 ChEBI: CHEBI:45807 IUPAC Name: 2-thiophen-2-ylacetic acid SMILES: C1=CSC(=C1)CC(=O)O
| PubChem CID | 15970 |
|---|---|
| CAS | 1918-77-0 |
| Molecular Weight (g/mol) | 142.172 |
| ChEBI | CHEBI:45807 |
| MDL Number | MFCD00005458 |
| SMILES | C1=CSC(=C1)CC(=O)O |
| Synonym | 2-thiopheneacetic acid,2-thienylacetic acid,thiopheneacetic acid,2-thiophen-2-yl acetic acid,thiophene-2-acetic acid,2-2-thienyl acetic acid,2-thiophene acetic acid,thiophen-2-ylacetic acid,thien-2-yl acetic acid,2-carboxymethyl thiophene |
| IUPAC Name | 2-thiophen-2-ylacetic acid |
| InChI Key | SMJRBWINMFUUDS-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2S |
1H-Benzimidazole-2-carboxylic acid hydrate, 90%, Thermo Scientific™
CAS: 849776-47-2 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.163 InChI Key: YQHUUYLPOCNBKD-UHFFFAOYSA-N Synonym: 1h-benzo d imidazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylic acid monohydrate,benzimidazole-2-carboxylic acid monohydrate,1h-1,3-benzodiazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylicacid, hydrate 1:1,c8h6n2o2.h2o,2-carboxy-1h-benzimidazole hydrate,1h-benzimidazole-2-carboxylic acid-water 1/1 PubChem CID: 18525703 IUPAC Name: 1H-benzimidazole-2-carboxylic acid;hydrate SMILES: C1=CC=C2C(=C1)NC(=N2)C(=O)O.O
| PubChem CID | 18525703 |
|---|---|
| CAS | 849776-47-2 |
| Molecular Weight (g/mol) | 180.163 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)C(=O)O.O |
| Synonym | 1h-benzo d imidazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylic acid monohydrate,benzimidazole-2-carboxylic acid monohydrate,1h-1,3-benzodiazole-2-carboxylic acid hydrate,1h-benzimidazole-2-carboxylicacid, hydrate 1:1,c8h6n2o2.h2o,2-carboxy-1h-benzimidazole hydrate,1h-benzimidazole-2-carboxylic acid-water 1/1 |
| IUPAC Name | 1H-benzimidazole-2-carboxylic acid;hydrate |
| InChI Key | YQHUUYLPOCNBKD-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2O3 |
4-(1H-1,2,4-triazol-1-yl)aniline, 97%, Thermo Scientific™
CAS: 6523-49-5 Molecular Formula: C8H8N4 Molecular Weight (g/mol): 160.18 MDL Number: MFCD00171470 InChI Key: BLNPEJXSNSBBNM-UHFFFAOYSA-N Synonym: 4-1,2,4 triazol-1-yl-phenylamine,4-1h-1,2,4-triazol-1-yl aniline,4-1,2,4-triazol-1-yl aniline,1-4-aminophenyl-1,2,4-triazole,triazolylaniline,1-4'-aminophenyl-1,2,4-triazole,benzenamine, 4-1h-1,2,4-triazol-1-yl,4-1h-1,2,4-triazol-1-yl benzenamine,4-1,2,4-triazolyl phenylamine,pubchem3927 PubChem CID: 735826 IUPAC Name: 4-(1,2,4-triazol-1-yl)aniline SMILES: C1=CC(=CC=C1N)N2C=NC=N2
| PubChem CID | 735826 |
|---|---|
| CAS | 6523-49-5 |
| Molecular Weight (g/mol) | 160.18 |
| MDL Number | MFCD00171470 |
| SMILES | C1=CC(=CC=C1N)N2C=NC=N2 |
| Synonym | 4-1,2,4 triazol-1-yl-phenylamine,4-1h-1,2,4-triazol-1-yl aniline,4-1,2,4-triazol-1-yl aniline,1-4-aminophenyl-1,2,4-triazole,triazolylaniline,1-4'-aminophenyl-1,2,4-triazole,benzenamine, 4-1h-1,2,4-triazol-1-yl,4-1h-1,2,4-triazol-1-yl benzenamine,4-1,2,4-triazolyl phenylamine,pubchem3927 |
| IUPAC Name | 4-(1,2,4-triazol-1-yl)aniline |
| InChI Key | BLNPEJXSNSBBNM-UHFFFAOYSA-N |
| Molecular Formula | C8H8N4 |
3-Furancarboximidamide hydrochloride, Technical Grade, Thermo Scientific™
CAS: 54649-21-7 Molecular Formula: C5H7ClN2O Molecular Weight (g/mol): 146.574 InChI Key: RJLCJJIXGGSRPZ-UHFFFAOYSA-N Synonym: furan-3-carboximidamide hydrochloride,3-furancarboximidamide hydrochloride,furan-3-carboxamidine hcl,furan-3-carboxamidine, chloride,3-furancarboximidamide,hydrochloride 1:1 PubChem CID: 2779666 IUPAC Name: furan-3-carboximidamide;hydrochloride SMILES: C1=COC=C1C(=N)N.Cl
| PubChem CID | 2779666 |
|---|---|
| CAS | 54649-21-7 |
| Molecular Weight (g/mol) | 146.574 |
| SMILES | C1=COC=C1C(=N)N.Cl |
| Synonym | furan-3-carboximidamide hydrochloride,3-furancarboximidamide hydrochloride,furan-3-carboxamidine hcl,furan-3-carboxamidine, chloride,3-furancarboximidamide,hydrochloride 1:1 |
| IUPAC Name | furan-3-carboximidamide;hydrochloride |
| InChI Key | RJLCJJIXGGSRPZ-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClN2O |
3,5-Dimethyl-1-phenyl-1H-pyrazole-4-carbonitrile, ≥97%, Thermo Scientific™
CAS: 23198-55-2 Molecular Formula: C12H11N3 Molecular Weight (g/mol): 197.241 MDL Number: MFCD08435888 InChI Key: WOFAIVGOIVCZJJ-UHFFFAOYSA-N Synonym: 3,5-dimethyl-1-phenyl-1h-pyrazole-4-carbonitrile,1h-pyrazole-4-carbonitrile,3,5-dimethyl-1-phenyl PubChem CID: 12208701 IUPAC Name: 3,5-dimethyl-1-phenylpyrazole-4-carbonitrile SMILES: CC1=C(C(=NN1C2=CC=CC=C2)C)C#N
| PubChem CID | 12208701 |
|---|---|
| CAS | 23198-55-2 |
| Molecular Weight (g/mol) | 197.241 |
| MDL Number | MFCD08435888 |
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)C#N |
| Synonym | 3,5-dimethyl-1-phenyl-1h-pyrazole-4-carbonitrile,1h-pyrazole-4-carbonitrile,3,5-dimethyl-1-phenyl |
| IUPAC Name | 3,5-dimethyl-1-phenylpyrazole-4-carbonitrile |
| InChI Key | WOFAIVGOIVCZJJ-UHFFFAOYSA-N |
| Molecular Formula | C12H11N3 |