2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-[2-(dimethylamino)-2-phenyl-ethyl]propanamide

Systemtic Name: 2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-[2-(dimethylamino)-2-phenyl-ethyl]propanamide Openeye Name: 2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-[2-(dimethylamino)-2-phenyl-ethyl]propanamide CAS Name: 2-[(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)thio]-N-[2-(dimethylamino)-2-phenylethyl]propanamide IUPAC Name: 2-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-[2-(dimethylamino)-2-phenylethyl]propanamide Traditional Name: 2-[(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)thio]-N-[2-(dimethylamino)-2-phenyl-ethyl]propionamide Formula: C26H27N5OS MolecularWeight: 457.59048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N5OS/c1-17-14-24(31-22-13-9-8-12-21(22)29-25(31)20(17)15-27)33-18(2)26(32)28-16-23(30(3)4)19-10-6-5-7-11-19/h5-14,18,23H,16H2,1-4H3,(H,28,32)