4-tert-butyl-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)-1-naphthyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)-1-naphthalenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)-1-naphthyl]benzenesulfonamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC4=NC=NN4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC4=NC=NN4

InChI

InChI=1S/C22H22N4O3S2/c1-22(2,3)14-8-10-15(11-9-14)31(28,29)26-18-12-19(30-21-23-13-24-25-21)20(27)17-7-5-4-6-16(17)18/h4-13,26-27H,1-3H3,(H,23,24,25)