1-(5-bromanylthiophen-2-yl)-2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanone hydrobromide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanone hydrobromide Openeye Name: 2-(1-benzyl-5-methoxy-benzimidazol-2-yl)sulfanyl-1-(5-bromo-2-thienyl)ethanone hydrobromide CAS Name: 1-(5-bromo-2-thiophenyl)-2-[[5-methoxy-1-(phenylmethyl)-2-benzimidazolyl]thio]ethanone hydrobromide IUPAC Name: 2-(1-benzyl-5-methoxybenzimidazol-2-yl)sulfanyl-1-(5-bromothiophen-2-yl)ethanone hydrobromide Traditional Name: 2-[(1-benzyl-5-methoxy-benzimidazol-2-yl)thio]-1-(5-bromo-2-thienyl)ethanone hydrobromide Formula: C21H18Br2N2O2S2 MolecularWeight: 554.31782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=N2)SCC(=O)C3=CC=C(S3)Br)CC4=CC=CC=C4.Br

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=N2)SCC(=O)C3=CC=C(S3)Br)CC4=CC=CC=C4.Br

InChI

InChI=1S/C21H17BrN2O2S2.BrH/c1-26-15-7-8-17-16(11-15)23-21(24(17)12-14-5-3-2-4-6-14)27-13-18(25)19-9-10-20(22)28-19;/h2-11H,12-13H2,1H3;1H