1-(4-chlorophenyl)carbonyl-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]piperidine-3-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]piperidine-3-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]piperidine-3-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]nipecotamide Formula: C21H26ClN3O2S MolecularWeight: 419.96804

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)Cl)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)Cl)C3=CSC=C3

InChI

InChI=1S/C21H26ClN3O2S/c1-24(2)19(17-9-11-28-14-17)12-23-20(26)16-4-3-10-25(13-16)21(27)15-5-7-18(22)8-6-15/h5-9,11,14,16,19H,3-4,10,12-13H2,1-2H3,(H,23,26)