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

Systemtic Name: ethyl (2S)-2-[[6-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-2-phenyl-ethanoate Openeye Name: ethyl (2S)-2-[[6-(2-methoxy-2-oxo-ethyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-2-phenyl-acetate CAS Name: (2S)-2-[[6-(2-methoxy-2-oxoethyl)-4-oxo-1H-pyrimidin-2-yl]thio]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[6-(2-methoxy-2-oxoethyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-2-phenylacetate Traditional Name: (2S)-2-[[4-keto-6-(2-keto-2-methoxy-ethyl)-1H-pyrimidin-2-yl]thio]-2-phenyl-acetic acid ethyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5S/c1-3-24-16(22)15(11-7-5-4-6-8-11)25-17-18-12(9-13(20)19-17)10-14(21)23-2/h4-9,15H,3,10H2,1-2H3,(H,18,19,20)/t15-/m0/s1