N-[(4-fluorophenyl)methyl]-2-(phenylsulfonyl)-5-thiophen-2-yl-1,2,4-triazol-3-amine

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(phenylsulfonyl)-5-thiophen-2-yl-1,2,4-triazol-3-amine Openeye Name: 2-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]-5-(2-thienyl)-1,2,4-triazol-3-amine CAS Name: 2-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]-5-thiophen-2-yl-1,2,4-triazol-3-amine IUPAC Name: 2-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]-5-thiophen-2-yl-1,2,4-triazol-3-amine Traditional Name: [2-besyl-5-(2-thienyl)-1,2,4-triazol-3-yl]-(4-fluorobenzyl)amine Formula: C19H15FN4O2S2 MolecularWeight: 414.476403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=CS3)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C(=NC(=N2)C3=CC=CS3)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C19H15FN4O2S2/c20-15-10-8-14(9-11-15)13-21-19-22-18(17-7-4-12-27-17)23-24(19)28(25,26)16-5-2-1-3-6-16/h1-12H,13H2,(H,21,22,23)