N-(2-chloranyl-4-methyl-phenyl)-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-acetamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)thio]acetamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)sulfanylacetamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-[(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)thio]acetamide Formula: C22H17ClN4OS MolecularWeight: 420.91458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C)Cl

InChI

InChI=1S/C22H17ClN4OS/c1-13-7-8-17(16(23)9-13)25-20(28)12-29-21-10-14(2)15(11-24)22-26-18-5-3-4-6-19(18)27(21)22/h3-10H,12H2,1-2H3,(H,25,28)