4-[(2E)-2-(4-oxidanidyl-6-oxidanylidene-1-phenyl-2-sulfanylidene-pyrimidin-5-ylidene)hydrazinyl]benzenesulfonate

Systemtic Name: 4-[(2E)-2-(4-oxidanidyl-6-oxidanylidene-1-phenyl-2-sulfanylidene-pyrimidin-5-ylidene)hydrazinyl]benzenesulfonate Openeye Name: 4-[(2E)-2-(4-oxido-6-oxo-1-phenyl-2-thioxo-pyrimidin-5-ylidene)hydrazino]benzenesulfonate CAS Name: 4-[(2E)-2-(4-oxido-6-oxo-1-phenyl-2-sulfanylidene-5-pyrimidinylidene)hydrazinyl]benzenesulfonate IUPAC Name: 4-[(2E)-2-(4-oxido-6-oxo-1-phenyl-2-sulfanylidenepyrimidin-5-ylidene)hydrazinyl]benzenesulfonate Traditional Name: 4-[(N'E)-N'-(6-keto-4-oxido-1-phenyl-2-thioxo-pyrimidin-5-ylidene)hydrazino]besylate Formula: C16H10N4O5S2-2 MolecularWeight: 402.4044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=NNC3=CC=C(C=C3)S(=O)(=O)[O-])C(=NC2=S)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=N/NC3=CC=C(C=C3)S(=O)(=O)[O-])/C(=NC2=S)[O-]

InChI

InChI=1S/C16H12N4O5S2/c21-14-13(19-18-10-6-8-12(9-7-10)27(23,24)25)15(22)20(16(26)17-14)11-4-2-1-3-5-11/h1-9,18H,(H,17,21,26)(H,23,24,25)/p-2/b19-13+