1-(3-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(3-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(3-bromophenyl)-2-[(1-methyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(3-bromophenyl)-2-(1-methylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(3-bromophenyl)-2-[(1-methylimidazol-2-yl)thio]ethanone Formula: C12H11BrN2OS MolecularWeight: 311.19754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CN1C=CN=C1SCC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H11BrN2OS/c1-15-6-5-14-12(15)17-8-11(16)9-3-2-4-10(13)7-9/h2-7H,8H2,1H3