N-(3-methylsulfanylpropyl)-6-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: N-(3-methylsulfanylpropyl)-6-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: N-(3-methylsulfanylpropyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: N-[3-(methylthio)propyl]-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: N-(3-methylsulfanylpropyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 6-keto-N-[3-(methylthio)propyl]-1-[3-(trifluoromethyl)benzyl]nipecotamide Formula: C18H23F3N2O2S MolecularWeight: 388.44763

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=O)C1CCC(=O)N(C1)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CSCCCNC(=O)C1CCC(=O)N(C1)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C18H23F3N2O2S/c1-26-9-3-8-22-17(25)14-6-7-16(24)23(12-14)11-13-4-2-5-15(10-13)18(19,20)21/h2,4-5,10,14H,3,6-9,11-12H2,1H3,(H,22,25)