5-cyclopropyl-N-(2-methyl-1-oxidanyl-propan-2-yl)-1-[4-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]pyrazole-4-carboxamide

Systemtic Name: 5-cyclopropyl-N-(2-methyl-1-oxidanyl-propan-2-yl)-1-[4-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-N-(2-hydroxy-1,1-dimethyl-ethyl)-1-[4-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-N-(1-hydroxy-2-methylpropan-2-yl)-1-[4-[2-(trifluoromethyl)phenyl]-2-pyrimidinyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-(1-hydroxy-2-methylpropan-2-yl)-1-[4-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-N-(2-hydroxy-1,1-dimethyl-ethyl)-1-[4-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]pyrazole-4-carboxamide Formula: C22H22F3N5O2 MolecularWeight: 445.43759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC(=O)C1=C(N(N=C1)C2=NC=CC(=N2)C3=CC=CC=C3C(F)(F)F)C4CC4

Isomeric SMILES

CC(C)(CO)NC(=O)C1=C(N(N=C1)C2=NC=CC(=N2)C3=CC=CC=C3C(F)(F)F)C4CC4

InChI

InChI=1S/C22H22F3N5O2/c1-21(2,12-31)29-19(32)15-11-27-30(18(15)13-7-8-13)20-26-10-9-17(28-20)14-5-3-4-6-16(14)22(23,24)25/h3-6,9-11,13,31H,7-8,12H2,1-2H3,(H,29,32)