1-[2,4-bis(oxidanyl)phenyl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[2,4-bis(oxidanyl)phenyl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(2,4-dihydroxyphenyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(2,4-dihydroxyphenyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-(2,4-dihydroxyphenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanone Traditional Name: 1-(2,4-dihydroxyphenyl)-2-[(1-isobutylbenzimidazol-2-yl)thio]ethanone Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c1-12(2)10-21-16-6-4-3-5-15(16)20-19(21)25-11-18(24)14-8-7-13(22)9-17(14)23/h3-9,12,22-23H,10-11H2,1-2H3