2-[3-[(E)-(4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]phenoxy]ethanoate

Systemtic Name: 2-[3-[(E)-(4-oxidanidyl-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene)methyl]phenoxy]ethanoate Openeye Name: 2-[3-[(E)-(4-oxido-6-oxo-2-thioxo-pyrimidin-5-ylidene)methyl]phenoxy]acetate CAS Name: 2-[3-[(E)-(4-oxido-6-oxo-2-sulfanylidene-5-pyrimidinylidene)methyl]phenoxy]acetate IUPAC Name: 2-[3-[(E)-(4-oxido-6-oxo-2-sulfanylidenepyrimidin-5-ylidene)methyl]phenoxy]acetate Traditional Name: 2-[3-[(E)-(6-keto-4-oxido-2-thioxo-pyrimidin-5-ylidene)methyl]phenoxy]acetate Formula: C13H8N2O5S-2 MolecularWeight: 304.27802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O5S/c16-10(17)6-20-8-3-1-2-7(4-8)5-9-11(18)14-13(21)15-12(9)19/h1-5H,6H2,(H,16,17)(H2,14,15,18,19,21)/p-2