1-[2-tert-butyl-4-[phenyl-[6-(trifluoromethyl)pyridin-3-yl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone

Systemtic Name: 1-[2-tert-butyl-4-[phenyl-[6-(trifluoromethyl)pyridin-3-yl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[2-tert-butyl-4-[phenyl-[6-(trifluoromethyl)-3-pyridyl]methyl]piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[2-tert-butyl-4-[phenyl-[6-(trifluoromethyl)-3-pyridinyl]methyl]-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[2-tert-butyl-4-[phenyl-[6-(trifluoromethyl)pyridin-3-yl]methyl]piperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[2-tert-butyl-4-[phenyl-[6-(trifluoromethyl)-3-pyridyl]methyl]piperazino]-2-(4-piperidyl)ethanone Formula: C28H37F3N4O MolecularWeight: 502.61479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=CC=C3)C4=CN=C(C=C4)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=CC=C3)C4=CN=C(C=C4)C(F)(F)F

InChI

InChI=1S/C28H37F3N4O/c1-27(2,3)24-19-34(15-16-35(24)25(36)17-20-11-13-32-14-12-20)26(21-7-5-4-6-8-21)22-9-10-23(33-18-22)28(29,30)31/h4-10,18,20,24,26,32H,11-17,19H2,1-3H3