ethyl 2-azanyl-5-[2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-[2-(1H-benzimidazol-2-yl)-2-cyano-ethenyl]thiophene-3-carboxylate Openeye Name: ethyl 2-amino-5-[2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]thiophene-3-carboxylate CAS Name: 2-amino-5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]thiophene-3-carboxylate Traditional Name: 2-amino-5-[2-(1H-benzimidazol-2-yl)-2-cyano-vinyl]thiophene-3-carboxylic acid ethyl ester Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)N

InChI

InChI=1S/C17H14N4O2S/c1-2-23-17(22)12-8-11(24-15(12)19)7-10(9-18)16-20-13-5-3-4-6-14(13)21-16/h3-8H,2,19H2,1H3,(H,20,21)