1-(azepan-1-yl)-2-[2-(3-bromophenyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-(3-bromophenyl)benzimidazol-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-(3-bromophenyl)benzimidazol-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[2-(3-bromophenyl)-1-benzimidazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-(3-bromophenyl)benzimidazol-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[2-(3-bromophenyl)benzimidazol-1-yl]ethanone Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2C4=CC(=CC=C4)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H22BrN3O/c22-17-9-7-8-16(14-17)21-23-18-10-3-4-11-19(18)25(21)15-20(26)24-12-5-1-2-6-13-24/h3-4,7-11,14H,1-2,5-6,12-13,15H2