2-[(3-chlorophenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(3-chlorophenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(3-chlorophenyl)methylthio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(3-chlorophenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(3-chlorobenzyl)thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C16H13ClN2OS MolecularWeight: 316.80522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1)CSCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1)CSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H13ClN2OS/c17-13-5-3-4-12(8-13)10-21-11-14-9-16(20)19-7-2-1-6-15(19)18-14/h1-9H,10-11H2