2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(4-bromophenyl)ethanone hydrobromide

Systemtic Name: 2-[2-azanylidene-3-(phenylmethyl)benzimidazol-1-yl]-1-(4-bromophenyl)ethanone hydrobromide Openeye Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(4-bromophenyl)ethanone hydrobromide CAS Name: 1-(4-bromophenyl)-2-[2-imino-3-(phenylmethyl)-1-benzimidazolyl]ethanone hydrobromide IUPAC Name: 2-(3-benzyl-2-iminobenzimidazol-1-yl)-1-(4-bromophenyl)ethanone hydrobromide Traditional Name: 2-(3-benzyl-2-imino-benzimidazol-1-yl)-1-(4-bromophenyl)ethanone hydrobromide Formula: C22H19Br2N3O MolecularWeight: 501.21376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC=C(C=C4)Br.Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N(C2=N)CC(=O)C4=CC=C(C=C4)Br.Br

InChI

InChI=1S/C22H18BrN3O.BrH/c23-18-12-10-17(11-13-18)21(27)15-26-20-9-5-4-8-19(20)25(22(26)24)14-16-6-2-1-3-7-16;/h1-13,24H,14-15H2;1H