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

Systemtic Name: 1-tert-butyl-5-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]-6-methyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-tert-butyl-5-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-6-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-tert-butyl-5-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-6-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-tert-butyl-5-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-6-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-tert-butyl-5-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]-6-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H27N5O2/c1-15-24-20-18(13-23-27(20)22(2,3)4)21(29)26(15)12-10-19(28)25-11-9-16-7-5-6-8-17(16)14-25/h5-8,13H,9-12,14H2,1-4H3