4-[[2-azanyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-4-yl]amino]butan-1-ol; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 4-[[2-azanyl-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-4-yl]amino]butan-1-ol; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 4-[[2-amino-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-4-yl]amino]butan-1-ol; 2,2,2-trifluoroacetic acid CAS Name: 4-[[2-amino-7-[2-(trifluoromethyl)phenyl]-4-pyrido[2,3-d]pyrimidinyl]amino]-1-butanol; 2,2,2-trifluoroacetic acid IUPAC Name: 4-[[2-amino-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-4-yl]amino]butan-1-ol; 2,2,2-trifluoroacetic acid Traditional Name: 4-[[2-amino-7-[2-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-4-yl]amino]butan-1-ol; 2,2,2-trifluoroacetic acid Formula: C20H19F6N5O3 MolecularWeight: 491.386979

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(C=C2)C(=NC(=N3)N)NCCCCO)C(F)(F)F.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(C=C2)C(=NC(=N3)N)NCCCCO)C(F)(F)F.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C18H18F3N5O.C2HF3O2/c19-18(20,21)13-6-2-1-5-11(13)14-8-7-12-15(23-9-3-4-10-27)25-17(22)26-16(12)24-14;3-2(4,5)1(6)7/h1-2,5-8,27H,3-4,9-10H2,(H3,22,23,24,25,26);(H,6,7)