1-[3,4-bis(oxidanyl)phenyl]-2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-ethanone Openeye Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-(3,4-dihydroxyphenyl)ethanone CAS Name: 2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-1-(3,4-dihydroxyphenyl)ethanone IUPAC Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-(3,4-dihydroxyphenyl)ethanone Traditional Name: 2-[[1-(4-bromophenyl)imidazol-2-yl]thio]-1-(3,4-dihydroxyphenyl)ethanone Formula: C17H13BrN2O3S MolecularWeight: 405.26572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=CN=C2SCC(=O)C3=CC(=C(C=C3)O)O)Br

Isomeric SMILES

C1=CC(=CC=C1N2C=CN=C2SCC(=O)C3=CC(=C(C=C3)O)O)Br

InChI

InChI=1S/C17H13BrN2O3S/c18-12-2-4-13(5-3-12)20-8-7-19-17(20)24-10-16(23)11-1-6-14(21)15(22)9-11/h1-9,21-22H,10H2