1-(3-bromanyl-4-methoxy-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(3-bromo-4-methoxyphenyl)-2-[(1-methyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-2-(1-methylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(3-bromo-4-methoxy-phenyl)-2-[(1-methylimidazol-2-yl)thio]ethanone Formula: C13H13BrN2O2S MolecularWeight: 341.22352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrN2O2S/c1-16-6-5-15-13(16)19-8-11(17)9-3-4-12(18-2)10(14)7-9/h3-7H,8H2,1-2H3