Compound 7. 5-tert-Butyl-N-(3-(3-(2-(2,6-dimethylpiperidin-1-yl)ethylcarbamoyl)-1-(6-(methylamino)pyrimidin-4-yl)-1H-pyrazol-5-ylamino)-4-methylphenyl)nicotinamide.

Molecular Weight: 638.81

Elemental Analysis: C, 65.81; H, 7.26; N, 21.93; O, 5.01

InChI: 1/C35H46N10O2/c1-22-11-12-27(41-33(46)25-15-26(20-37-19-25)35(4,5)6)16-28(22)42-32-17-29(43-45(32)31-18-30(36-7)39-21-40-31)34(47)38-13-14-44-23(2)9-8-10-24(44)3/h11-12,15-21,23-24,42H,8-10,13-14H2,1-7H3,(H,38,47)(H,41,46)(H,36,39,40)

Standard InChI: 1S/C35H46N10O2/c1-22-11-12-27(41-33(46)25-15-26(20-37-19-25)35(4,5)6)16-28(22)42-32-17-29(43-45(32)31-18-30(36-7)39-21-40-31)34(47)38-13-14-44-23(2)9-8-10-24(44)3/h11-12,15-21,23-24,42H,8-10,13-14H2,1-7H3,(H,38,47)(H,41,46)(H,36,39,40)

InChIKey: LNAHUAHKCHSIKW-UHFFFAOYAO

Standard InChIKey: LNAHUAHKCHSIKW-UHFFFAOYSA-N

SMILES: CNC1=NC=NC(N2C(NC3=C(C)C=CC(NC(C4=CN=CC(C(C)(C)C)=C4)=O)=C3)=CC(C(NCCN5C(C)CCCC5C)=O)=N2)=C1

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Chemical Formula: C₃₅H₄₆N₁₀O₂