1-[1-(4-methylsulfanylbutan-2-yl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[1-(4-methylsulfanylbutan-2-yl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[1-(1-methyl-3-methylsulfanyl-propyl)-4-piperidyl]-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[1-[4-(methylthio)butan-2-yl]-4-piperidinyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[1-(4-methylsulfanylbutan-2-yl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[1-[1-methyl-3-(methylthio)propyl]-4-piperidyl]-N-(3-pyridylmethyl)isonipecotamide Formula: C22H36N4OS MolecularWeight: 404.61244

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCSC)N1CCC(CC1)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(CCSC)N1CCC(CC1)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H36N4OS/c1-18(9-15-28-2)25-13-7-21(8-14-25)26-11-5-20(6-12-26)22(27)24-17-19-4-3-10-23-16-19/h3-4,10,16,18,20-21H,5-9,11-15,17H2,1-2H3,(H,24,27)