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

Systemtic Name: 5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine Openeye Name: N-benzyl-5-(4-methoxyphenyl)-2-(p-tolylsulfonyl)-1,2,4-triazol-3-amine CAS Name: 5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine IUPAC Name: N-benzyl-5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-1,2,4-triazol-3-amine Traditional Name: benzyl-[5-(4-methoxyphenyl)-2-tosyl-1,2,4-triazol-3-yl]amine Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=C(C=C3)OC)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=C(C=C3)OC)NCC4=CC=CC=C4

InChI

InChI=1S/C23H22N4O3S/c1-17-8-14-21(15-9-17)31(28,29)27-23(24-16-18-6-4-3-5-7-18)25-22(26-27)19-10-12-20(30-2)13-11-19/h3-15H,16H2,1-2H3,(H,24,25,26)