(2R)-2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(3-methylphenyl)propanamide

Systemtic Name: (2R)-2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(3-methylphenyl)propanamide Openeye Name: (2R)-2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(m-tolyl)propanamide CAS Name: (2R)-2-[(4-cyano-3-ethyl-1-pyrido[1,2-a]benzimidazolyl)thio]-N-(3-methylphenyl)propanamide IUPAC Name: (2R)-2-(4-cyano-3-ethylpyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(3-methylphenyl)propanamide Traditional Name: (2R)-2-[(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)thio]-N-(m-tolyl)propionamide Formula: C24H22N4OS MolecularWeight: 414.52268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SC(C)C(=O)NC4=CC=CC(=C4)C)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)S[C@H](C)C(=O)NC4=CC=CC(=C4)C)C#N

InChI

InChI=1S/C24H22N4OS/c1-4-17-13-22(30-16(3)24(29)26-18-9-7-8-15(2)12-18)28-21-11-6-5-10-20(21)27-23(28)19(17)14-25/h5-13,16H,4H2,1-3H3,(H,26,29)/t16-/m1/s1