1-[3,4-bis(oxidanyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone Formula: C10H9N3O3S MolecularWeight: 251.26176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CSC2=NC=NN2)O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CSC2=NC=NN2)O)O

InChI

InChI=1S/C10H9N3O3S/c14-7-2-1-6(3-8(7)15)9(16)4-17-10-11-5-12-13-10/h1-3,5,14-15H,4H2,(H,11,12,13)