N-(2-bromophenyl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]ethanamide Openeye Name: N-(2-bromophenyl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]acetamide CAS Name: N-(2-bromophenyl)-2-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]acetamide IUPAC Name: N-(2-bromophenyl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]acetamide Traditional Name: N-(2-bromophenyl)-2-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]acetamide Formula: C12H12BrN5O2S MolecularWeight: 370.22498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CNC(=O)CSC2=NC=NN2)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CNC(=O)CSC2=NC=NN2)Br

InChI

InChI=1S/C12H12BrN5O2S/c13-8-3-1-2-4-9(8)17-10(19)5-14-11(20)6-21-12-15-7-16-18-12/h1-4,7H,5-6H2,(H,14,20)(H,17,19)(H,15,16,18)