ethyl 2-[5-methyl-4-oxidanylidene-1-(phenylcarbonyl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[5-methyl-4-oxidanylidene-1-(phenylcarbonyl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-(1-benzoyl-5-methyl-4-oxo-pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(1-benzoyl-5-methyl-4-oxo-2-pyrimidinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzoyl-5-methyl-4-oxopyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(1-benzoyl-4-keto-5-methyl-pyrimidin-2-yl)thio]acetic acid ethyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=O)C(=CN1C(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)CSC1=NC(=O)C(=CN1C(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H16N2O4S/c1-3-22-13(19)10-23-16-17-14(20)11(2)9-18(16)15(21)12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3