3-[4-(2,3-dihydro-1-benzofuran-3-ylamino)phenyl]-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-[4-(2,3-dihydro-1-benzofuran-3-ylamino)phenyl]-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 3-[4-(2,3-dihydrobenzofuran-3-ylamino)phenyl]-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-[4-(2,3-dihydrobenzofuran-3-ylamino)phenyl]-1-(4-piperidinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-[4-(2,3-dihydro-1-benzofuran-3-ylamino)phenyl]-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-coumaran-3-yl-amine Formula: C24H25N7O MolecularWeight: 427.5016

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C3=C(C(=N2)C4=CC=C(C=C4)NC5COC6=CC=CC=C56)C(=NC=N3)N

Isomeric SMILES

C1CNCCC1N2C3=C(C(=N2)C4=CC=C(C=C4)NC5COC6=CC=CC=C56)C(=NC=N3)N

InChI

InChI=1S/C24H25N7O/c25-23-21-22(30-31(24(21)28-14-27-23)17-9-11-26-12-10-17)15-5-7-16(8-6-15)29-19-13-32-20-4-2-1-3-18(19)20/h1-8,14,17,19,26,29H,9-13H2,(H2,25,27,28)