6-[4-butoxy-2,6-bis(fluoranyl)phenyl]-5-chloranyl-N-[(2S)-1,1,1-tris(fluoranyl)propan-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 6-[4-butoxy-2,6-bis(fluoranyl)phenyl]-5-chloranyl-N-[(2S)-1,1,1-tris(fluoranyl)propan-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine Openeye Name: 6-(4-butoxy-2,6-difluoro-phenyl)-5-chloro-N-[(1S)-2,2,2-trifluoro-1-methyl-ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine CAS Name: 6-(4-butoxy-2,6-difluorophenyl)-5-chloro-N-[(2S)-1,1,1-trifluoropropan-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine IUPAC Name: 6-(4-butoxy-2,6-difluorophenyl)-5-chloro-N-[(2S)-1,1,1-trifluoropropan-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine Traditional Name: [6-(4-butoxy-2,6-difluoro-phenyl)-5-chloro-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-[(1S)-2,2,2-trifluoro-1-methyl-ethyl]amine Formula: C18H17ClF5N5O MolecularWeight: 449.805496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C(=C1)F)C2=C(N3C(=NC=N3)N=C2Cl)NC(C)C(F)(F)F)F

Isomeric SMILES

CCCCOC1=CC(=C(C(=C1)F)C2=C(N3C(=NC=N3)N=C2Cl)N[C@@H](C)C(F)(F)F)F

InChI

InChI=1S/C18H17ClF5N5O/c1-3-4-5-30-10-6-11(20)13(12(21)7-10)14-15(19)28-17-25-8-26-29(17)16(14)27-9(2)18(22,23)24/h6-9,27H,3-5H2,1-2H3/t9-/m0/s1