N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C20H27F3N4O4S MolecularWeight: 476.51299

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2CCN(CC2)CC(=O)N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2CCN(CC2)CC(=O)N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H27F3N4O4S/c21-20(22,23)15-2-1-3-17(12-15)32(30,31)27-10-4-14(5-11-27)19(29)25-16-6-8-26(9-7-16)13-18(24)28/h1-3,12,14,16H,4-11,13H2,(H2,24,28)(H,25,29)