5-[(S)-(6-oxidanidyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-phenyl-methyl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate

Systemtic Name: 5-[(S)-(6-oxidanidyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-phenyl-methyl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate Openeye Name: 5-[(S)-(6-oxido-4-oxo-2-thioxo-1H-pyrimidin-5-yl)-phenyl-methyl]-2-thioxo-1H-pyrimidine-4,6-diolate CAS Name: 5-[(S)-(6-oxido-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-phenylmethyl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate IUPAC Name: 5-[(S)-(6-oxido-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-phenylmethyl]-2-sulfanylidene-1H-pyrimidine-4,6-diolate Traditional Name: 5-[(S)-(4-keto-6-oxido-2-thioxo-1H-pyrimidin-5-yl)-phenyl-methyl]-2-thioxo-1H-pyrimidine-4,6-diolate Formula: C15H9N4O4S2-3 MolecularWeight: 373.38636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(NC(=S)NC2=O)[O-])C3=C(NC(=S)N=C3[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C2=C(NC(=S)NC2=O)[O-])C3=C(NC(=S)N=C3[O-])[O-]

InChI

InChI=1S/C15H12N4O4S2/c20-10-8(11(21)17-14(24)16-10)7(6-4-2-1-3-5-6)9-12(22)18-15(25)19-13(9)23/h1-5,7H,(H3,16,17,20,21,24)(H3,18,19,22,23,25)/p-3