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

Systemtic Name: 4-[6-(2,6-dimethylmorpholin-4-yl)-3-[3-(trifluoromethyl)phenyl]pyridazin-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine Openeye Name: 4-[6-(2,6-dimethylmorpholin-4-yl)-3-[3-(trifluoromethyl)phenyl]pyridazin-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine CAS Name: 4-[6-(2,6-dimethyl-4-morpholinyl)-3-[3-(trifluoromethyl)phenyl]-4-pyridazinyl]-N-[(1S)-1-phenylethyl]-2-pyrimidinamine IUPAC Name: 4-[6-(2,6-dimethylmorpholin-4-yl)-3-[3-(trifluoromethyl)phenyl]pyridazin-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine Traditional Name: [4-[6-(2,6-dimethylmorpholino)-3-[3-(trifluoromethyl)phenyl]pyridazin-4-yl]pyrimidin-2-yl]-[(1S)-1-phenylethyl]amine Formula: C29H29F3N6O MolecularWeight: 534.57537

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=NN=C(C(=C2)C3=NC(=NC=C3)NC(C)C4=CC=CC=C4)C5=CC(=CC=C5)C(F)(F)F

Isomeric SMILES

CC1CN(CC(O1)C)C2=NN=C(C(=C2)C3=NC(=NC=C3)N[C@@H](C)C4=CC=CC=C4)C5=CC(=CC=C5)C(F)(F)F

InChI

InChI=1S/C29H29F3N6O/c1-18-16-38(17-19(2)39-18)26-15-24(27(37-36-26)22-10-7-11-23(14-22)29(30,31)32)25-12-13-33-28(35-25)34-20(3)21-8-5-4-6-9-21/h4-15,18-20H,16-17H2,1-3H3,(H,33,34,35)/t18?,19?,20-/m0/s1