ethyl 3-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate

Systemtic Name: ethyl 3-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate Openeye Name: ethyl 3-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate CAS Name: 3-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanoate Traditional Name: 3-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]propionic acid ethyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC(=O)C=C(N1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCSC1=NC(=O)C=C(N1)C2=CC=CC=C2

InChI

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