1-(3-bromanyl-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(3-bromo-4-methoxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(3-bromo-4-methoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C12H12BrN3O2S MolecularWeight: 342.21158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12BrN3O2S/c1-16-7-14-15-12(16)19-6-10(17)8-3-4-11(18-2)9(13)5-8/h3-5,7H,6H2,1-2H3