N-(2-cyanoethyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-phenyl-propanamide

Systemtic Name: N-(2-cyanoethyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-phenyl-propanamide Openeye Name: N-(2-cyanoethyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-phenyl-propanamide CAS Name: N-(2-cyanoethyl)-2-[(1-methyl-2-benzimidazolyl)thio]-N-phenylpropanamide IUPAC Name: N-(2-cyanoethyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-N-phenylpropanamide Traditional Name: N-(2-cyanoethyl)-2-[(1-methylbenzimidazol-2-yl)thio]-N-phenyl-propionamide Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CCC#N)C1=CC=CC=C1)SC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC(C(=O)N(CCC#N)C1=CC=CC=C1)SC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C20H20N4OS/c1-15(26-20-22-17-11-6-7-12-18(17)23(20)2)19(25)24(14-8-13-21)16-9-4-3-5-10-16/h3-7,9-12,15H,8,14H2,1-2H3