4-tert-butyl-2,6-dimethyl-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-2,6-dimethyl-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-2,6-dimethyl-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-2,6-dimethyl-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-2,6-dimethyl-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-2,6-dimethyl-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzenesulfonamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)NC2=CC=CC(=C2)N3C=NN=C3SC)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)NC2=CC=CC(=C2)N3C=NN=C3SC)C)C(C)(C)C

InChI

InChI=1S/C21H26N4O2S2/c1-14-10-16(21(3,4)5)11-15(2)19(14)29(26,27)24-17-8-7-9-18(12-17)25-13-22-23-20(25)28-6/h7-13,24H,1-6H3