N-[4-(4-bromanylphenoxy)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[4-(4-bromanylphenoxy)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[4-(4-bromophenoxy)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[4-(4-bromophenoxy)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[4-(4-bromophenoxy)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[4-(4-bromophenoxy)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C16H13BrN4O2S MolecularWeight: 405.26902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=NC=NN2)OC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=NC=NN2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN4O2S/c17-11-1-5-13(6-2-11)23-14-7-3-12(4-8-14)20-15(22)9-24-16-18-10-19-21-16/h1-8,10H,9H2,(H,20,22)(H,18,19,21)