1-(4-bromophenyl)carbonyl-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]isonipecotamide Formula: C21H26BrN3O2S MolecularWeight: 464.41904

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

InChI

InChI=1S/C21H26BrN3O2S/c1-24(2)18(19-4-3-13-28-19)14-23-20(26)15-9-11-25(12-10-15)21(27)16-5-7-17(22)8-6-16/h3-8,13,15,18H,9-12,14H2,1-2H3,(H,23,26)