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

Systemtic Name: 5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Openeye Name: 5-(4-methoxyphenyl)-2-(p-tolylsulfonyl)-N-(2-thienylmethyl)-1,2,4-triazol-3-amine CAS Name: 5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine IUPAC Name: 5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Traditional Name: [5-(4-methoxyphenyl)-2-tosyl-1,2,4-triazol-3-yl]-(2-thenyl)amine Formula: C21H20N4O3S2 MolecularWeight: 440.5385

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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=CS4

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O3S2/c1-15-5-11-19(12-6-15)30(26,27)25-21(22-14-18-4-3-13-29-18)23-20(24-25)16-7-9-17(28-2)10-8-16/h3-13H,14H2,1-2H3,(H,22,23,24)