2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethyl-2-pyrrolyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[3-cyano-1-[(4-fluorophenyl)methyl]-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[3-cyano-1-(4-fluorobenzyl)-4,5-dimethyl-pyrrol-2-yl]acetamide Formula: C23H20FN5OS MolecularWeight: 433.501203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3N2)CC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3N2)CC4=CC=C(C=C4)F)C

InChI

InChI=1S/C23H20FN5OS/c1-14-15(2)29(12-16-7-9-17(24)10-8-16)22(18(14)11-25)28-21(30)13-31-23-26-19-5-3-4-6-20(19)27-23/h3-10H,12-13H2,1-2H3,(H,26,27)(H,28,30)