6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-2,3-dihydroisoindol-1-one

Systemtic Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-2,3-dihydroisoindol-1-one Openeye Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]isoindolin-1-one CAS Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-2-pyrimidinyl]amino]-2,3-dihydroisoindol-1-one IUPAC Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoropyrimidin-2-yl]amino]-2,3-dihydroisoindol-1-one Traditional Name: 6-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]isoindolin-1-one Formula: C21H18FN7O MolecularWeight: 403.412323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC5=C(CNC5=O)C=C4

Isomeric SMILES

CCN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC5=C(CNC5=O)C=C4

InChI

InChI=1S/C21H18FN7O/c1-2-29(18-5-3-4-17-15(18)10-25-28-17)19-16(22)11-24-21(27-19)26-13-7-6-12-9-23-20(30)14(12)8-13/h3-8,10-11H,2,9H2,1H3,(H,23,30)(H,25,28)(H,24,26,27)