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

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-[(1-phenethyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(1-phenethylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-[(1-phenethylbenzimidazol-2-yl)thio]ethanone Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC(=O)C4=CC(=C(C=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC(=O)C4=CC(=C(C=C4)O)O

InChI

InChI=1S/C23H20N2O3S/c26-20-11-10-17(14-21(20)27)22(28)15-29-23-24-18-8-4-5-9-19(18)25(23)13-12-16-6-2-1-3-7-16/h1-11,14,26-27H,12-13,15H2