2,4,5-trimethyl-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 2,4,5-trimethyl-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]benzenesulfonamide Openeye Name: N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]-2,4,5-trimethyl-benzenesulfonamide CAS Name: N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)phenyl]-2,4,5-trimethylbenzenesulfonamide IUPAC Name: N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]-2,4,5-trimethylbenzenesulfonamide Traditional Name: N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)phenyl]-2,4,5-trimethyl-benzenesulfonamide Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NC2=CC(=C(C=C2)O)SC3=NC=NN3)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)NC2=CC(=C(C=C2)O)SC3=NC=NN3)C

InChI

InChI=1S/C17H18N4O3S2/c1-10-6-12(3)16(7-11(10)2)26(23,24)21-13-4-5-14(22)15(8-13)25-17-18-9-19-20-17/h4-9,21-22H,1-3H3,(H,18,19,20)