2-(4-methylphenyl)sulfonyl-5-phenyl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine

Systemtic Name: 2-(4-methylphenyl)sulfonyl-5-phenyl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Openeye Name: 5-phenyl-2-(p-tolylsulfonyl)-N-(2-thienylmethyl)-1,2,4-triazol-3-amine CAS Name: 2-(4-methylphenyl)sulfonyl-5-phenyl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine IUPAC Name: 2-(4-methylphenyl)sulfonyl-5-phenyl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Traditional Name: (5-phenyl-2-tosyl-1,2,4-triazol-3-yl)-(2-thenyl)amine Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CS4

InChI

InChI=1S/C20H18N4O2S2/c1-15-9-11-18(12-10-15)28(25,26)24-20(21-14-17-8-5-13-27-17)22-19(23-24)16-6-3-2-4-7-16/h2-13H,14H2,1H3,(H,21,22,23)