5-fluoranyl-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 5-fluoranyl-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 5-fluoro-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine; 2,2,2-trifluoroacetic acid CAS Name: 5-fluoro-N4-(1H-indazol-4-yl)-N4-methyl-N2-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine; 2,2,2-trifluoroacetic acid IUPAC Name: 5-fluoro-4-N-(1H-indazol-4-yl)-4-N-methyl-2-N-(3-methylsulfonylphenyl)pyrimidine-2,4-diamine; 2,2,2-trifluoroacetic acid Traditional Name: [5-fluoro-2-(3-mesylanilino)pyrimidin-4-yl]-(1H-indazol-4-yl)-methyl-amine; 2,2,2-trifluoroacetic acid Formula: C21H18F4N6O4S MolecularWeight: 526.464033

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)C.C(=O)(C(F)(F)F)O

Isomeric SMILES

CN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)C.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C19H17FN6O2S.C2HF3O2/c1-26(17-8-4-7-16-14(17)10-22-25-16)18-15(20)11-21-19(24-18)23-12-5-3-6-13(9-12)29(2,27)28;3-2(4,5)1(6)7/h3-11H,1-2H3,(H,22,25)(H,21,23,24);(H,6,7)