N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C21H25F3N4O3S MolecularWeight: 470.50841

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C21H25F3N4O3S/c1-26(2)18(19-4-3-11-32-19)13-25-20(29)14-7-9-27(10-8-14)16-6-5-15(21(22,23)24)12-17(16)28(30)31/h3-6,11-12,14,18H,7-10,13H2,1-2H3,(H,25,29)