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

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-[(1-methyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-[(1-methylbenzimidazol-2-yl)thio]ethanone Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C16H14N2O3S/c1-18-12-5-3-2-4-11(12)17-16(18)22-9-15(21)10-6-7-13(19)14(20)8-10/h2-8,19-20H,9H2,1H3