N-(1-phenylethyl)-4-[6-piperidin-4-yl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]pyrimidin-2-amine

Systemtic Name: N-(1-phenylethyl)-4-[6-piperidin-4-yl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]pyrimidin-2-amine Openeye Name: N-(1-phenylethyl)-4-[6-(4-piperidyl)-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]pyrimidin-2-amine CAS Name: N-(1-phenylethyl)-4-[6-(4-piperidinyl)-4-[3-(trifluoromethyl)phenyl]-3-pyridazinyl]-2-pyrimidinamine IUPAC Name: N-(1-phenylethyl)-4-[6-piperidin-4-yl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]pyrimidin-2-amine Traditional Name: 1-phenylethyl-[4-[6-(4-piperidyl)-4-[3-(trifluoromethyl)phenyl]pyridazin-3-yl]pyrimidin-2-yl]amine Formula: C28H27F3N6 MolecularWeight: 504.54939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)C3=NN=C(C=C3C4=CC(=CC=C4)C(F)(F)F)C5CCNCC5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)C3=NN=C(C=C3C4=CC(=CC=C4)C(F)(F)F)C5CCNCC5

InChI

InChI=1S/C28H27F3N6/c1-18(19-6-3-2-4-7-19)34-27-33-15-12-24(35-27)26-23(21-8-5-9-22(16-21)28(29,30)31)17-25(36-37-26)20-10-13-32-14-11-20/h2-9,12,15-18,20,32H,10-11,13-14H2,1H3,(H,33,34,35)