5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine

Systemtic Name: 5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine Openeye Name: N-benzyl-5-(p-tolyl)-2-(p-tolylsulfonyl)-1,2,4-triazol-3-amine CAS Name: 5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine IUPAC Name: N-benzyl-5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-1,2,4-triazol-3-amine Traditional Name: benzyl-[5-(p-tolyl)-2-tosyl-1,2,4-triazol-3-yl]amine Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H22N4O2S/c1-17-8-12-20(13-9-17)22-25-23(24-16-19-6-4-3-5-7-19)27(26-22)30(28,29)21-14-10-18(2)11-15-21/h3-15H,16H2,1-2H3,(H,24,25,26)