1-[1-[(2S)-1-methylsulfanylpropan-2-yl]piperidin-4-yl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[1-[(2S)-1-methylsulfanylpropan-2-yl]piperidin-4-yl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[1-[(1S)-1-methyl-2-methylsulfanyl-ethyl]-4-piperidyl]-N-(2-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[1-[(2S)-1-(methylthio)propan-2-yl]-4-piperidinyl]-N-(2-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[1-[(2S)-1-methylsulfanylpropan-2-yl]piperidin-4-yl]-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[1-[(1S)-1-methyl-2-(methylthio)ethyl]-4-piperidyl]-N-(2-pyridylmethyl)isonipecotamide Formula: C21H34N4OS MolecularWeight: 390.58586

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC)N1CCC(CC1)N2CCC(CC2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

C[C@@H](CSC)N1CCC(CC1)N2CCC(CC2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C21H34N4OS/c1-17(16-27-2)24-13-8-20(9-14-24)25-11-6-18(7-12-25)21(26)23-15-19-5-3-4-10-22-19/h3-5,10,17-18,20H,6-9,11-16H2,1-2H3,(H,23,26)/t17-/m0/s1