2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(3,5-dimethyl-4-oxidanyl-phenyl)ethanone hydrobromide

Systemtic Name: 2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(3,5-dimethyl-4-oxidanyl-phenyl)ethanone hydrobromide Openeye Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(4-hydroxy-3,5-dimethyl-phenyl)ethanone hydrobromide CAS Name: 1-(4-hydroxy-3,5-dimethylphenyl)-2-[2-imino-3-(phenylmethyl)-1-benzimidazolyl]ethanone hydrobromide IUPAC Name: 2-(3-benzyl-2-iminobenzimidazol-1-yl)-1-(4-hydroxy-3,5-dimethylphenyl)ethanone hydrobromide Traditional Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(4-hydroxy-3,5-dimethyl-phenyl)ethanone hydrobromide Formula: C24H24BrN3O2 MolecularWeight: 466.37026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C(=O)CN2C3=CC=CC=C3N(C2=N)CC4=CC=CC=C4.Br

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C(=O)CN2C3=CC=CC=C3N(C2=N)CC4=CC=CC=C4.Br

InChI

InChI=1S/C24H23N3O2.BrH/c1-16-12-19(13-17(2)23(16)29)22(28)15-27-21-11-7-6-10-20(21)26(24(27)25)14-18-8-4-3-5-9-18;/h3-13,25,29H,14-15H2,1-2H3;1H