(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: (6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: (6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid (6-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid (4-keto-6-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)COC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)COC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O3S/c1-13-3-2-4-17-21-15(11-18(23)22(13)17)12-25-19(24)9-10-26-16-7-5-14(20)6-8-16/h2-8,11H,9-10,12H2,1H3