4-[3-[(2-bromophenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide

Systemtic Name: 4-[3-[(2-bromophenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide Openeye Name: 4-[3-[(2-bromophenyl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]benzenesulfonamide CAS Name: 4-[3-[(2-bromophenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide IUPAC Name: 4-[3-[(2-bromophenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide Traditional Name: 4-[3-(2-bromobenzyl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzenesulfonamide Formula: C15H13BrN4O2S2 MolecularWeight: 425.32332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=NNC(=S)N2C3=CC=C(C=C3)S(=O)(=O)N)Br

Isomeric SMILES

C1=CC=C(C(=C1)CC2=NNC(=S)N2C3=CC=C(C=C3)S(=O)(=O)N)Br

InChI

InChI=1S/C15H13BrN4O2S2/c16-13-4-2-1-3-10(13)9-14-18-19-15(23)20(14)11-5-7-12(8-6-11)24(17,21)22/h1-8H,9H2,(H,19,23)(H2,17,21,22)