N-[(2R)-2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(2R)-2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(2R)-2-(dimethylamino)-2-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(2R)-2-(dimethylamino)-2-(2-thienyl)ethyl]isonipecotamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN(C)[C@H](CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C20H27N3O3S2/c1-22(2)18(19-9-6-14-27-19)15-21-20(24)16-10-12-23(13-11-16)28(25,26)17-7-4-3-5-8-17/h3-9,14,16,18H,10-13,15H2,1-2H3,(H,21,24)/t18-/m1/s1