N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-4,5-dimethyl-1-phenyl-2-pyrrolyl)-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(3-cyano-4,5-dimethyl-1-phenylpyrrol-2-yl)-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC=CN2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC=CN2C)C3=CC=CC=C3)C

InChI

InChI=1S/C19H19N5OS/c1-13-14(2)24(15-7-5-4-6-8-15)18(16(13)11-20)22-17(25)12-26-19-21-9-10-23(19)3/h4-10H,12H2,1-3H3,(H,22,25)