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

Systemtic Name: 2-[2-methoxy-4-[(E)-[1-(4-methoxyphenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]phenoxy]ethanoate Openeye Name: 2-[2-methoxy-4-[(E)-[1-(4-methoxyphenyl)-4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene]methyl]phenoxy]acetate CAS Name: 2-[2-methoxy-4-[(E)-[1-(4-methoxyphenyl)-4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene]methyl]phenoxy]acetate IUPAC Name: 2-[2-methoxy-4-[(E)-[1-(4-methoxyphenyl)-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene]methyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-[6-keto-1-(4-methoxyphenyl)-4-oxido-2-thioxo-pyrimidin-5-ylidene]methyl]-2-methoxy-phenoxy]acetate Formula: C21H16N2O7S-2 MolecularWeight: 440.42594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)[O-])OC)C(=NC2=S)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3)OCC(=O)[O-])OC)/C(=NC2=S)[O-]

InChI

InChI=1S/C21H18N2O7S/c1-28-14-6-4-13(5-7-14)23-20(27)15(19(26)22-21(23)31)9-12-3-8-16(17(10-12)29-2)30-11-18(24)25/h3-10H,11H2,1-2H3,(H,24,25)(H,22,26,31)/p-2/b15-9+