2-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethyl benzoate

Systemtic Name: 2-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethyl benzoate Openeye Name: 2-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)ethyl benzoate CAS Name: benzoic acid 2-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]ethyl ester IUPAC Name: 2-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)ethyl benzoate Traditional Name: benzoic acid 2-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]ethyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H16N2O3S/c1-10-12(13(18)17-15(16-10)21-2)8-9-20-14(19)11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,16,17,18)