N-[1-tert-butyl-3-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzamide

Systemtic Name: N-[1-tert-butyl-3-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzamide Openeye Name: N-[1-tert-butyl-3-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzamide CAS Name: N-[1-tert-butyl-3-(4-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]benzamide IUPAC Name: N-[1-tert-butyl-3-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzamide Traditional Name: N-[1-tert-butyl-3-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]benzamide Formula: C22H20FN5O MolecularWeight: 389.425503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)C3=CC=C(C=C3)F)C(=NC=N2)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)C3=CC=C(C=C3)F)C(=NC=N2)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20FN5O/c1-22(2,3)28-20-17(18(27-28)14-9-11-16(23)12-10-14)19(24-13-25-20)26-21(29)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,24,25,26,29)