N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoranyl-N2-(1-methylindazol-5-yl)pyrimidine-2,4-diamine

Systemtic Name: N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoranyl-N2-(1-methylindazol-5-yl)pyrimidine-2,4-diamine Openeye Name: N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoro-N2-(1-methylindazol-5-yl)pyrimidine-2,4-diamine CAS Name: N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoro-N2-(1-methyl-5-indazolyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoro-2-N-(1-methylindazol-5-yl)pyrimidine-2,4-diamine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[5-fluoro-2-[(1-methylindazol-5-yl)amino]pyrimidin-4-yl]amine Formula: C20H17FN6O2 MolecularWeight: 392.386383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC3=NC=C(C(=N3)NC4=CC5=C(C=C4)OCCO5)F)C=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC3=NC=C(C(=N3)NC4=CC5=C(C=C4)OCCO5)F)C=N1

InChI

InChI=1S/C20H17FN6O2/c1-27-16-4-2-13(8-12(16)10-23-27)25-20-22-11-15(21)19(26-20)24-14-3-5-17-18(9-14)29-7-6-28-17/h2-5,8-11H,6-7H2,1H3,(H2,22,24,25,26)