N-cyclopropyl-3-[[1-(2-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[[1-(2-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[[1-(2-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[[1-(2-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[[1-(2-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[[1-(2-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]-4-methyl-benzamide Formula: C22H19FN6O MolecularWeight: 402.424263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC3=NC=NC4=C3C=NN4C5=CC=CC=C5F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC3=NC=NC4=C3C=NN4C5=CC=CC=C5F

InChI

InChI=1S/C22H19FN6O/c1-13-6-7-14(22(30)27-15-8-9-15)10-18(13)28-20-16-11-26-29(21(16)25-12-24-20)19-5-3-2-4-17(19)23/h2-7,10-12,15H,8-9H2,1H3,(H,27,30)(H,24,25,28)