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

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-5-(4-methylphenyl)-N-(phenylmethyl)-1,2,4-triazol-3-amine Openeye Name: N-benzyl-2-(4-chlorophenyl)sulfonyl-5-(p-tolyl)-1,2,4-triazol-3-amine CAS Name: 2-(4-chlorophenyl)sulfonyl-5-(4-methylphenyl)-N-(phenylmethyl)-1,2,4-triazol-3-amine IUPAC Name: N-benzyl-2-(4-chlorophenyl)sulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine Traditional Name: benzyl-[2-(4-chlorophenyl)sulfonyl-5-(p-tolyl)-1,2,4-triazol-3-yl]amine Formula: C22H19ClN4O2S MolecularWeight: 438.92986

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN4O2S/c1-16-7-9-18(10-8-16)21-25-22(24-15-17-5-3-2-4-6-17)27(26-21)30(28,29)20-13-11-19(23)12-14-20/h2-14H,15H2,1H3,(H,24,25,26)