1-tert-butyl-5-[3-(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-oxidanylidene-propyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-tert-butyl-5-[3-(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-oxidanylidene-propyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-tert-butyl-5-[3-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-oxo-propyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-tert-butyl-5-[3-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-tert-butyl-5-[3-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-tert-butyl-5-[3-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-keto-propyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H26FN5O2 MolecularWeight: 411.472543

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N1C(=O)CCN3C=NC4=C(C3=O)C=NN4C(C)(C)C)C=CC(=C2)F

Isomeric SMILES

CC1CCC2=C(N1C(=O)CCN3C=NC4=C(C3=O)C=NN4C(C)(C)C)C=CC(=C2)F

InChI

InChI=1S/C22H26FN5O2/c1-14-5-6-15-11-16(23)7-8-18(15)27(14)19(29)9-10-26-13-24-20-17(21(26)30)12-25-28(20)22(2,3)4/h7-8,11-14H,5-6,9-10H2,1-4H3