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

Systemtic Name: 5-tert-butyl-2-methyl-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide Openeye Name: 5-tert-butyl-2-methyl-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide CAS Name: 5-tert-butyl-2-methyl-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzenesulfonamide IUPAC Name: 5-tert-butyl-2-methyl-N-[3-(3-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]benzenesulfonamide Traditional Name: 5-tert-butyl-2-methyl-N-[3-[3-(methylthio)-1,2,4-triazol-4-yl]phenyl]benzenesulfonamide Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=CC(=C2)N3C=NN=C3SC

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=CC(=C2)N3C=NN=C3SC

InChI

InChI=1S/C20H24N4O2S2/c1-14-9-10-15(20(2,3)4)11-18(14)28(25,26)23-16-7-6-8-17(12-16)24-13-21-22-19(24)27-5/h6-13,23H,1-5H3