1-[(3-bromophenyl)methyl]-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methyl]-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]-N-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-N-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)-N-(2-keto-1,3-dimethyl-benzimidazol-5-yl)isonipecotamide Formula: C22H25BrN4O2 MolecularWeight: 457.3635

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)CC4=CC(=CC=C4)Br)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)C3CCN(CC3)CC4=CC(=CC=C4)Br)N(C1=O)C

InChI

InChI=1S/C22H25BrN4O2/c1-25-19-7-6-18(13-20(19)26(2)22(25)29)24-21(28)16-8-10-27(11-9-16)14-15-4-3-5-17(23)12-15/h3-7,12-13,16H,8-11,14H2,1-2H3,(H,24,28)