N-[[(2S)-4-(phenylmethyl)morpholin-2-yl]methyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine

Systemtic Name: N-[[(2S)-4-(phenylmethyl)morpholin-2-yl]methyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine Openeye Name: N-[[(2S)-4-benzylmorpholin-2-yl]methyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine CAS Name: N-[[(2S)-4-(phenylmethyl)-2-morpholinyl]methyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine IUPAC Name: N-[[(2S)-4-benzylmorpholin-2-yl]methyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine Traditional Name: [(2S)-4-benzylmorpholin-2-yl]methyl-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]amine Formula: C18H19F3N6O MolecularWeight: 392.37827

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1CC2=CC=CC=C2)CNC3=NN4C(=NN=C4C(F)(F)F)C=C3

Isomeric SMILES

C1CO[C@H](CN1CC2=CC=CC=C2)CNC3=NN4C(=NN=C4C(F)(F)F)C=C3

InChI

InChI=1S/C18H19F3N6O/c19-18(20,21)17-24-23-16-7-6-15(25-27(16)17)22-10-14-12-26(8-9-28-14)11-13-4-2-1-3-5-13/h1-7,14H,8-12H2,(H,22,25)/t14-/m0/s1