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

Systemtic Name: (2R)-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-propanamide CAS Name: (2R)-2-[(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-2-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)sulfanylpropanamide Traditional Name: (2R)-N-benzyl-2-[(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)thio]propionamide Formula: C23H20N4OS MolecularWeight: 400.4961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SC(C)C(=O)NCC4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)S[C@H](C)C(=O)NCC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H20N4OS/c1-15-12-21(29-16(2)23(28)25-14-17-8-4-3-5-9-17)27-20-11-7-6-10-19(20)26-22(27)18(15)13-24/h3-12,16H,14H2,1-2H3,(H,25,28)/t16-/m1/s1