1-methylsulfonyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]isonipecotamide Formula: C18H24F3N3O3S MolecularWeight: 419.46167

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C18H24F3N3O3S/c1-28(26,27)24-10-6-13(7-11-24)17(25)22-15-12-14(18(19,20)21)4-5-16(15)23-8-2-3-9-23/h4-5,12-13H,2-3,6-11H2,1H3,(H,22,25)