2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-ethanamide Openeye Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethyl-acetamide CAS Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N,N-dimethylacetamide IUPAC Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-dimethylacetamide Traditional Name: 2-[[5-(4-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N,N-dimethyl-acetamide Formula: C13H15BrN4OS MolecularWeight: 355.2534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N(C)C)C2=CC=C(C=C2)Br

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N(C)C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H15BrN4OS/c1-17(2)11(19)8-20-13-16-15-12(18(13)3)9-4-6-10(14)7-5-9/h4-7H,8H2,1-3H3