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

Systemtic Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]piperidine-4-carboxamide Openeye Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(4-cyanophenyl)sulfonyl-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]isonipecotamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C#N)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C#N)C3=CSC=C3

InChI

InChI=1S/C21H26N4O3S2/c1-24(2)20(18-9-12-29-15-18)14-23-21(26)17-7-10-25(11-8-17)30(27,28)19-5-3-16(13-22)4-6-19/h3-6,9,12,15,17,20H,7-8,10-11,14H2,1-2H3,(H,23,26)