3-(2-bromophenyl)-5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-(2-bromophenyl)-5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-(2-bromophenyl)-5-methylsulfanyl-1,2,4-triazole CAS Name: 3-(2-bromophenyl)-5-(methylthio)-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-(2-bromophenyl)-5-methylsulfanyl-1,2,4-triazole Traditional Name: 4-benzyl-3-(2-bromophenyl)-5-(methylthio)-1,2,4-triazole Formula: C16H14BrN3S MolecularWeight: 360.27146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=C3Br

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=C3Br

InChI

InChI=1S/C16H14BrN3S/c1-21-16-19-18-15(13-9-5-6-10-14(13)17)20(16)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3