N-cyclohexyl-1-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-cyclohexyl-1-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]piperidine-4-carboxamide Openeye Name: N-cyclohexyl-1-[1-(2-phenylsulfanylacetyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: N-cyclohexyl-1-[1-[1-oxo-2-(phenylthio)ethyl]-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: N-cyclohexyl-1-[1-(2-phenylsulfanylacetyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: N-cyclohexyl-1-[1-[2-(phenylthio)acetyl]-4-piperidyl]isonipecotamide Formula: C25H37N3O2S MolecularWeight: 443.64518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C25H37N3O2S/c29-24(19-31-23-9-5-2-6-10-23)28-17-13-22(14-18-28)27-15-11-20(12-16-27)25(30)26-21-7-3-1-4-8-21/h2,5-6,9-10,20-22H,1,3-4,7-8,11-19H2,(H,26,30)