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

Systemtic Name: 3-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-(1-phenylethyl)propanamide Openeye Name: 3-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-(1-phenylethyl)propanamide CAS Name: 3-[(7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-N-(1-phenylethyl)propanamide IUPAC Name: 3-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-(1-phenylethyl)propanamide Traditional Name: 3-[(4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-N-(1-phenylethyl)propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSCCC(=O)NC(C)C3=CC=CC=C3)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSCCC(=O)NC(C)C3=CC=CC=C3)C=C1

InChI

InChI=1S/C21H23N3O2S/c1-15-8-9-19-23-18(12-21(26)24(19)13-15)14-27-11-10-20(25)22-16(2)17-6-4-3-5-7-17/h3-9,12-13,16H,10-11,14H2,1-2H3,(H,22,25)