3-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(2,4-dihydroxyphenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(2,4-dihydroxyphenyl)-2-oxoethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-(2,4-dihydroxyphenyl)-2-keto-ethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-one Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)NN=C2SCC(=O)C3=C(C=C(C=C3)O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)NN=C2SCC(=O)C3=C(C=C(C=C3)O)O

InChI

InChI=1S/C16H13N3O4S/c20-11-6-7-12(13(21)8-11)14(22)9-24-16-18-17-15(23)19(16)10-4-2-1-3-5-10/h1-8,20-21H,9H2,(H,17,23)