2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-(3-methylphenyl)propanamide

Systemtic Name: 2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-(3-methylphenyl)propanamide Openeye Name: 2-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-(m-tolyl)propanamide CAS Name: 2-[(7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-N-(3-methylphenyl)propanamide IUPAC Name: 2-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-(3-methylphenyl)propanamide Traditional Name: 2-[(4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-N-(m-tolyl)propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)SCC2=CC(=O)N3C=C(C=CC3=N2)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(C)SCC2=CC(=O)N3C=C(C=CC3=N2)C

InChI

InChI=1S/C20H21N3O2S/c1-13-5-4-6-16(9-13)22-20(25)15(3)26-12-17-10-19(24)23-11-14(2)7-8-18(23)21-17/h4-11,15H,12H2,1-3H3,(H,22,25)