2-[(2-chlorophenyl)methylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(2-chlorophenyl)methylthio]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(2-chlorophenyl)methylsulfanylmethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(2-chlorobenzyl)thio]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C17H15ClN2OS MolecularWeight: 330.8318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSCC3=CC=CC=C3Cl)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSCC3=CC=CC=C3Cl)C=C1

InChI

InChI=1S/C17H15ClN2OS/c1-12-6-7-16-19-14(8-17(21)20(16)9-12)11-22-10-13-4-2-3-5-15(13)18/h2-9H,10-11H2,1H3