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

Systemtic Name: N-[4-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[5-[(4-tert-butylphenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[5-[(4-tert-butylbenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]-4-methyl-benzenesulfonamide Formula: C27H30N4O2S2 MolecularWeight: 506.6827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN=C(N3C)SCC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H30N4O2S2/c1-19-6-16-24(17-7-19)35(32,33)30-23-14-10-21(11-15-23)25-28-29-26(31(25)5)34-18-20-8-12-22(13-9-20)27(2,3)4/h6-17,30H,18H2,1-5H3