2-[2-(4-chloranylphenoxy)ethylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[2-(4-chloranylphenoxy)ethylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[2-(4-chlorophenoxy)ethylsulfanylmethyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[2-(4-chlorophenoxy)ethylthio]methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[2-(4-chlorophenoxy)ethylsulfanylmethyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[2-(4-chlorophenoxy)ethylthio]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C18H17ClN2O2S MolecularWeight: 360.85778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSCCOC3=CC=C(C=C3)Cl)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSCCOC3=CC=C(C=C3)Cl)C=C1

InChI

InChI=1S/C18H17ClN2O2S/c1-13-2-7-17-20-15(10-18(22)21(17)11-13)12-24-9-8-23-16-5-3-14(19)4-6-16/h2-7,10-11H,8-9,12H2,1H3