2-[(4-methylphenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(4-methylphenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-(p-tolylmethylsulfanylmethyl)pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(4-methylphenyl)methylthio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4-methylphenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4-methylbenzyl)thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC2=CC(=O)N3C=CC=CC3=N2

Isomeric SMILES

CC1=CC=C(C=C1)CSCC2=CC(=O)N3C=CC=CC3=N2

InChI

InChI=1S/C17H16N2OS/c1-13-5-7-14(8-6-13)11-21-12-15-10-17(20)19-9-3-2-4-16(19)18-15/h2-10H,11-12H2,1H3