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

Systemtic Name: 2-[2-methoxy-4-[(Z)-[1-(4-methylphenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]phenoxy]ethanoate Openeye Name: 2-[2-methoxy-4-[(Z)-[4-oxido-6-oxo-1-(p-tolyl)-2-thioxo-pyrimidin-5-ylidene]methyl]phenoxy]acetate CAS Name: 2-[2-methoxy-4-[(Z)-[1-(4-methylphenyl)-4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene]methyl]phenoxy]acetate IUPAC Name: 2-[2-methoxy-4-[(Z)-[1-(4-methylphenyl)-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene]methyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-[6-keto-4-oxido-1-(p-tolyl)-2-thioxo-pyrimidin-5-ylidene]methyl]-2-methoxy-phenoxy]acetate Formula: C21H16N2O6S-2 MolecularWeight: 424.42654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)[O-])OC)C(=NC2=S)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC(=C(C=C3)OCC(=O)[O-])OC)/C(=NC2=S)[O-]

InChI

InChI=1S/C21H18N2O6S/c1-12-3-6-14(7-4-12)23-20(27)15(19(26)22-21(23)30)9-13-5-8-16(17(10-13)28-2)29-11-18(24)25/h3-10H,11H2,1-2H3,(H,24,25)(H,22,26,30)/p-2/b15-9-