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

Systemtic Name: 2-(4-methylphenyl)sulfonyl-5-pyridin-3-yl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Openeye Name: 2-(p-tolylsulfonyl)-5-(3-pyridyl)-N-(2-thienylmethyl)-1,2,4-triazol-3-amine CAS Name: 2-(4-methylphenyl)sulfonyl-5-(3-pyridinyl)-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine IUPAC Name: 2-(4-methylphenyl)sulfonyl-5-pyridin-3-yl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Traditional Name: [5-(3-pyridyl)-2-tosyl-1,2,4-triazol-3-yl]-(2-thenyl)amine Formula: C19H17N5O2S2 MolecularWeight: 411.50058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N5O2S2/c1-14-6-8-17(9-7-14)28(25,26)24-19(21-13-16-5-3-11-27-16)22-18(23-24)15-4-2-10-20-12-15/h2-12H,13H2,1H3,(H,21,22,23)