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

Systemtic Name: ethyl 3-oxidanylidene-4-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]butanoate Openeye Name: ethyl 3-oxo-4-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]butanoate CAS Name: 3-oxo-4-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-4-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]butanoate Traditional Name: 3-keto-4-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]butyric acid ethyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O4S/c1-2-22-15(21)8-12(19)10-23-16-17-13(9-14(20)18-16)11-6-4-3-5-7-11/h3-7,9H,2,8,10H2,1H3,(H,17,18,20)