methyl 2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]acetic acid methyl ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=O)C=C(N1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CSC1=NC(=O)C=C(N1)C2=CC=CC=C2

InChI

InChI=1S/C13H12N2O3S/c1-18-12(17)8-19-13-14-10(7-11(16)15-13)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,14,15,16)