N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]propanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]propanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[(4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]propionamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSC(C)C(=O)NC3=C(C=C(C(=C3)C)Cl)OC)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSC(C)C(=O)NC3=C(C=C(C(=C3)C)Cl)OC)C=C1

InChI

InChI=1S/C21H22ClN3O3S/c1-12-5-6-19-23-15(8-20(26)25(19)10-12)11-29-14(3)21(27)24-17-7-13(2)16(22)9-18(17)28-4/h5-10,14H,11H2,1-4H3,(H,24,27)