2-(4-methylphenyl)sulfanyl-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]ethanamide Openeye Name: 2-(p-tolylsulfanyl)-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-[1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl]acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl]acetamide Traditional Name: 2-(p-tolylthio)-N-[1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl]acetamide Formula: C20H22F3N3OS MolecularWeight: 409.46839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3OS/c1-14-2-5-17(6-3-14)28-13-19(27)25-16-8-10-26(11-9-16)18-7-4-15(12-24-18)20(21,22)23/h2-7,12,16H,8-11,13H2,1H3,(H,25,27)