2-[1-(4-bromophenyl)carbonylbenzimidazol-2-yl]sulfanyl-1-phenyl-ethanone hydrobromide

Systemtic Name: 2-[1-(4-bromophenyl)carbonylbenzimidazol-2-yl]sulfanyl-1-phenyl-ethanone hydrobromide Openeye Name: 2-[1-(4-bromobenzoyl)benzimidazol-2-yl]sulfanyl-1-phenyl-ethanone hydrobromide CAS Name: 2-[[1-[(4-bromophenyl)-oxomethyl]-2-benzimidazolyl]thio]-1-phenylethanone hydrobromide IUPAC Name: 2-[1-(4-bromobenzoyl)benzimidazol-2-yl]sulfanyl-1-phenylethanone hydrobromide Traditional Name: 2-[[1-(4-bromobenzoyl)benzimidazol-2-yl]thio]-1-phenyl-ethanone hydrobromide Formula: C22H16Br2N2O2S MolecularWeight: 532.24764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2C(=O)C4=CC=C(C=C4)Br.Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3N2C(=O)C4=CC=C(C=C4)Br.Br

InChI

InChI=1S/C22H15BrN2O2S.BrH/c23-17-12-10-16(11-13-17)21(27)25-19-9-5-4-8-18(19)24-22(25)28-14-20(26)15-6-2-1-3-7-15;/h1-13H,14H2;1H