tert-butyl N-[6-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)quinolin-4-yl]carbamate

Systemtic Name: tert-butyl N-[6-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)quinolin-4-yl]carbamate Openeye Name: tert-butyl N-[6-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-4-quinolyl]carbamate CAS Name: N-[6-(4-amino-1-propan-2-yl-3-pyrazolo[3,4-d]pyrimidinyl)-4-quinolinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)quinolin-4-yl]carbamate Traditional Name: N-[6-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-4-quinolyl]carbamic acid tert-butyl ester Formula: C22H25N7O2 MolecularWeight: 419.4796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=N1)C3=CC4=C(C=CN=C4C=C3)NC(=O)OC(C)(C)C)C(=NC=N2)N

Isomeric SMILES

CC(C)N1C2=C(C(=N1)C3=CC4=C(C=CN=C4C=C3)NC(=O)OC(C)(C)C)C(=NC=N2)N

InChI

InChI=1S/C22H25N7O2/c1-12(2)29-20-17(19(23)25-11-26-20)18(28-29)13-6-7-15-14(10-13)16(8-9-24-15)27-21(30)31-22(3,4)5/h6-12H,1-5H3,(H2,23,25,26)(H,24,27,30)