2-[2-methoxy-4-[(E)-(4-oxidanidyl-6-oxidanylidene-1-phenyl-2-sulfanylidene-pyrimidin-5-ylidene)methyl]phenoxy]ethanoate

Systemtic Name: 2-[2-methoxy-4-[(E)-(4-oxidanidyl-6-oxidanylidene-1-phenyl-2-sulfanylidene-pyrimidin-5-ylidene)methyl]phenoxy]ethanoate Openeye Name: 2-[2-methoxy-4-[(E)-(4-oxido-6-oxo-1-phenyl-2-thioxo-pyrimidin-5-ylidene)methyl]phenoxy]acetate CAS Name: 2-[2-methoxy-4-[(E)-(4-oxido-6-oxo-1-phenyl-2-sulfanylidene-5-pyrimidinylidene)methyl]phenoxy]acetate IUPAC Name: 2-[2-methoxy-4-[(E)-(4-oxido-6-oxo-1-phenyl-2-sulfanylidenepyrimidin-5-ylidene)methyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-(6-keto-4-oxido-1-phenyl-2-thioxo-pyrimidin-5-ylidene)methyl]-2-methoxy-phenoxy]acetate Formula: C20H14N2O6S-2 MolecularWeight: 410.39996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=NC(=S)N(C2=O)C3=CC=CC=C3)[O-])OCC(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\C(=NC(=S)N(C2=O)C3=CC=CC=C3)[O-])OCC(=O)[O-]

InChI

InChI=1S/C20H16N2O6S/c1-27-16-10-12(7-8-15(16)28-11-17(23)24)9-14-18(25)21-20(29)22(19(14)26)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,23,24)(H,21,25,29)/p-2/b14-9+