1-(azepan-1-yl)-2-[2-(2,4-dichlorophenyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-(2,4-dichlorophenyl)benzimidazol-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-(2,4-dichlorophenyl)benzimidazol-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[2-(2,4-dichlorophenyl)-1-benzimidazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-(2,4-dichlorophenyl)benzimidazol-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[2-(2,4-dichlorophenyl)benzimidazol-1-yl]ethanone Formula: C21H21Cl2N3O MolecularWeight: 402.31694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21Cl2N3O/c22-15-9-10-16(17(23)13-15)21-24-18-7-3-4-8-19(18)26(21)14-20(27)25-11-5-1-2-6-12-25/h3-4,7-10,13H,1-2,5-6,11-12,14H2