methyl 4-[(Z)-3-methoxy-3-oxidanylidene-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(Z)-3-methoxy-3-oxidanylidene-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-1-enyl]benzoate Openeye Name: methyl 4-[(Z)-3-methoxy-3-oxo-2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)prop-1-enyl]benzoate CAS Name: 4-[(Z)-3-methoxy-3-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-3-methoxy-3-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)prop-1-enyl]benzoate Traditional Name: 4-[(Z)-3-keto-2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)-3-methoxy-prop-1-enyl]benzoic acid methyl ester Formula: C16H14N2O5S MolecularWeight: 346.35776

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C2=CC(=O)NC(=S)N2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(/C2=CC(=O)NC(=S)N2)\C(=O)OC

InChI

InChI=1S/C16H14N2O5S/c1-22-14(20)10-5-3-9(4-6-10)7-11(15(21)23-2)12-8-13(19)18-16(24)17-12/h3-8H,1-2H3,(H2,17,18,19,24)/b11-7-