2-(4-cyano-3-propyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(3,4-dimethylphenyl)ethanamide

Systemtic Name: 2-(4-cyano-3-propyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(3,4-dimethylphenyl)ethanamide Openeye Name: 2-(4-cyano-3-propyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(3,4-dimethylphenyl)acetamide CAS Name: 2-[(4-cyano-3-propyl-1-pyrido[1,2-a]benzimidazolyl)thio]-N-(3,4-dimethylphenyl)acetamide IUPAC Name: 2-(4-cyano-3-propylpyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(3,4-dimethylphenyl)acetamide Traditional Name: 2-[(4-cyano-3-propyl-pyrido[1,2-a]benzimidazol-1-yl)thio]-N-(3,4-dimethylphenyl)acetamide Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4=CC(=C(C=C4)C)C)C#N

Isomeric SMILES

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4=CC(=C(C=C4)C)C)C#N

InChI

InChI=1S/C25H24N4OS/c1-4-7-18-13-24(31-15-23(30)27-19-11-10-16(2)17(3)12-19)29-22-9-6-5-8-21(22)28-25(29)20(18)14-26/h5-6,8-13H,4,7,15H2,1-3H3,(H,27,30)