4-[5-[(Z)-[1-(3-ethoxyphenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]furan-2-yl]benzoate

Systemtic Name: 4-[5-[(Z)-[1-(3-ethoxyphenyl)-4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]methyl]furan-2-yl]benzoate Openeye Name: 4-[5-[(Z)-[1-(3-ethoxyphenyl)-4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene]methyl]-2-furyl]benzoate CAS Name: 4-[5-[(Z)-[1-(3-ethoxyphenyl)-4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene]methyl]-2-furanyl]benzoate IUPAC Name: 4-[5-[(Z)-[1-(3-ethoxyphenyl)-4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene]methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(Z)-(6-keto-1-m-phenetyl-4-oxido-2-thioxo-pyrimidin-5-ylidene)methyl]-2-furyl]benzoate Formula: C24H16N2O6S-2 MolecularWeight: 460.45864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)C(=O)[O-])C(=NC2=S)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1)N2C(=O)/C(=C\C3=CC=C(O3)C4=CC=C(C=C4)C(=O)[O-])/C(=NC2=S)[O-]

InChI

InChI=1S/C24H18N2O6S/c1-2-31-17-5-3-4-16(12-17)26-22(28)19(21(27)25-24(26)33)13-18-10-11-20(32-18)14-6-8-15(9-7-14)23(29)30/h3-13H,2H2,1H3,(H,29,30)(H,25,27,33)/p-2/b19-13-