N-(5-methoxy-2-piperidin-1-yl-phenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: N-(5-methoxy-2-piperidin-1-yl-phenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: N-[5-methoxy-2-(1-piperidyl)phenyl]-2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: N-[5-methoxy-2-(1-piperidinyl)phenyl]-2-(3-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: N-(5-methoxy-2-piperidin-1-ylphenyl)-2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: (5-methoxy-2-piperidino-phenyl)-[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amine Formula: C22H22F3N5O MolecularWeight: 429.43819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CCCCC2)NC3=NC(=NC(=C3)C(F)(F)F)C4=CN=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)N2CCCCC2)NC3=NC(=NC(=C3)C(F)(F)F)C4=CN=CC=C4

InChI

InChI=1S/C22H22F3N5O/c1-31-16-7-8-18(30-10-3-2-4-11-30)17(12-16)27-20-13-19(22(23,24)25)28-21(29-20)15-6-5-9-26-14-15/h5-9,12-14H,2-4,10-11H2,1H3,(H,27,28,29)