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

Systemtic Name: 2-(phenylsulfonyl)-5-pyridin-3-yl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Openeye Name: 2-(benzenesulfonyl)-5-(3-pyridyl)-N-(2-thienylmethyl)-1,2,4-triazol-3-amine CAS Name: 2-(benzenesulfonyl)-5-(3-pyridinyl)-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine IUPAC Name: 2-(benzenesulfonyl)-5-pyridin-3-yl-N-(thiophen-2-ylmethyl)-1,2,4-triazol-3-amine Traditional Name: [2-besyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]-(2-thenyl)amine Formula: C18H15N5O2S2 MolecularWeight: 397.474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N5O2S2/c24-27(25,16-8-2-1-3-9-16)23-18(20-13-15-7-5-11-26-15)21-17(22-23)14-6-4-10-19-12-14/h1-12H,13H2,(H,20,21,22)