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

Systemtic Name: 5-(4-methylphenyl)-N-(phenylmethyl)-2-(phenylsulfonyl)-1,2,4-triazol-3-amine Openeye Name: 2-(benzenesulfonyl)-N-benzyl-5-(p-tolyl)-1,2,4-triazol-3-amine CAS Name: 2-(benzenesulfonyl)-5-(4-methylphenyl)-N-(phenylmethyl)-1,2,4-triazol-3-amine IUPAC Name: 2-(benzenesulfonyl)-N-benzyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine Traditional Name: benzyl-[2-besyl-5-(p-tolyl)-1,2,4-triazol-3-yl]amine Formula: C22H20N4O2S MolecularWeight: 404.4848

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O2S/c1-17-12-14-19(15-13-17)21-24-22(23-16-18-8-4-2-5-9-18)26(25-21)29(27,28)20-10-6-3-7-11-20/h2-15H,16H2,1H3,(H,23,24,25)