[(3S)-3-[(4-oxidanyl-4-pyridin-2-yl-cyclohexyl)amino]pyrrolidin-1-yl]-[3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methanone

Systemtic Name: [(3S)-3-[(4-oxidanyl-4-pyridin-2-yl-cyclohexyl)amino]pyrrolidin-1-yl]-[3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methanone Openeye Name: [(3S)-3-[[4-hydroxy-4-(2-pyridyl)cyclohexyl]amino]pyrrolidin-1-yl]-[3-[3-(trifluoromethyl)phenyl]-4,5-dihydroisoxazol-5-yl]methanone CAS Name: [(3S)-3-[[4-hydroxy-4-(2-pyridinyl)cyclohexyl]amino]-1-pyrrolidinyl]-[3-[3-(trifluoromethyl)phenyl]-4,5-dihydroisoxazol-5-yl]methanone IUPAC Name: [(3S)-3-[(4-hydroxy-4-pyridin-2-ylcyclohexyl)amino]pyrrolidin-1-yl]-[3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methanone Traditional Name: [(3S)-3-[[4-hydroxy-4-(2-pyridyl)cyclohexyl]amino]pyrrolidino]-[3-[3-(trifluoromethyl)phenyl]-2-isoxazolin-5-yl]methanone Formula: C26H29F3N4O3 MolecularWeight: 502.52867

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2CCN(C2)C(=O)C3CC(=NO3)C4=CC(=CC=C4)C(F)(F)F)(C5=CC=CC=N5)O

Isomeric SMILES

C1CN(C[C@H]1NC2CCC(CC2)(C3=CC=CC=N3)O)C(=O)C4CC(=NO4)C5=CC(=CC=C5)C(F)(F)F

InChI

InChI=1S/C26H29F3N4O3/c27-26(28,29)18-5-3-4-17(14-18)21-15-22(36-32-21)24(34)33-13-9-20(16-33)31-19-7-10-25(35,11-8-19)23-6-1-2-12-30-23/h1-6,12,14,19-20,22,31,35H,7-11,13,15-16H2/t19?,20-,22?,25?/m0/s1