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

Systemtic Name: 2-[4-[(Z)-[1-(4-tert-butylphenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]-2-methoxy-phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-[1-(4-tert-butylphenyl)-4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene]methyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(Z)-[1-(4-tert-butylphenyl)-4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene]methyl]-2-methoxyphenoxy]acetate IUPAC Name: 2-[4-[(Z)-[1-(4-tert-butylphenyl)-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene]methyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(Z)-[1-(4-tert-butylphenyl)-6-keto-4-oxido-2-thioxo-pyrimidin-5-ylidene]methyl]-2-methoxy-phenoxy]acetate Formula: C24H22N2O6S-2 MolecularWeight: 466.50628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N2O6S/c1-24(2,3)15-6-8-16(9-7-15)26-22(30)17(21(29)25-23(26)33)11-14-5-10-18(19(12-14)31-4)32-13-20(27)28/h5-12H,13H2,1-4H3,(H,27,28)(H,25,29,33)/p-2/b17-11-