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

Systemtic Name: ethyl (2S)-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-phenyl-ethanoate Openeye Name: ethyl (2S)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-phenyl-acetate CAS Name: (2S)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-phenylacetate Traditional Name: (2S)-2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-2-phenyl-acetic acid ethyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SC2=NC(=O)C=C(N2)C

Isomeric SMILES

CCOC(=O)[C@H](C1=CC=CC=C1)SC2=NC(=O)C=C(N2)C

InChI

InChI=1S/C15H16N2O3S/c1-3-20-14(19)13(11-7-5-4-6-8-11)21-15-16-10(2)9-12(18)17-15/h4-9,13H,3H2,1-2H3,(H,16,17,18)/t13-/m0/s1