[(E)-1-oxidanyl-3-oxidanylidene-prop-1-en-2-yl] 3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)benzenesulfinate

Systemtic Name: [(E)-1-oxidanyl-3-oxidanylidene-prop-1-en-2-yl] 3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)benzenesulfinate Openeye Name: [(E)-1-formyl-2-hydroxy-vinyl] 3-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)benzenesulfinate CAS Name: 3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)benzenesulfinic acid [(E)-1-hydroxy-3-oxoprop-1-en-2-yl] ester IUPAC Name: [(E)-1-hydroxy-3-oxoprop-1-en-2-yl] 3-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)benzenesulfinate Traditional Name: 3-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)benzenesulfinic acid [(E)-1-formyl-2-hydroxy-vinyl] ester Formula: C11H9N3O4S2 MolecularWeight: 311.33686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)OC(=CO)C=O)C2=NC(=S)NN2

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)O/C(=C/O)/C=O)C2=NC(=S)NN2

InChI

InChI=1S/C11H9N3O4S2/c15-5-8(6-16)18-20(17)9-3-1-2-7(4-9)10-12-11(19)14-13-10/h1-6,15H,(H2,12,13,14,19)/b8-5+