N-ethyl-4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzamide

Systemtic Name: N-ethyl-4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzamide Openeye Name: N-ethyl-4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzamide CAS Name: N-ethyl-4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-2-pyrimidinyl]amino]benzamide IUPAC Name: N-ethyl-4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoropyrimidin-2-yl]amino]benzamide Traditional Name: N-ethyl-4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzamide Formula: C22H22FN7O MolecularWeight: 419.454783

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)N(CC)C3=CC=CC4=C3C=NN4)F

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)N(CC)C3=CC=CC4=C3C=NN4)F

InChI

InChI=1S/C22H22FN7O/c1-3-24-21(31)14-8-10-15(11-9-14)27-22-25-13-17(23)20(28-22)30(4-2)19-7-5-6-18-16(19)12-26-29-18/h5-13H,3-4H2,1-2H3,(H,24,31)(H,26,29)(H,25,27,28)