2-[3-[4-azanyl-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]azetidin-1-yl]-N-methyl-ethanamide

Systemtic Name: 2-[3-[4-azanyl-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]azetidin-1-yl]-N-methyl-ethanamide Openeye Name: 2-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]azetidin-1-yl]-N-methyl-acetamide CAS Name: 2-[3-[4-amino-3-(4-phenoxyphenyl)-1-pyrazolo[3,4-d]pyrimidinyl]-1-azetidinyl]-N-methylacetamide IUPAC Name: 2-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]azetidin-1-yl]-N-methylacetamide Traditional Name: 2-[3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]azetidin-1-yl]-N-methyl-acetamide Formula: C23H23N7O2 MolecularWeight: 429.47442

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN1CC(C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=NC=N3)N

Isomeric SMILES

CNC(=O)CN1CC(C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=NC=N3)N

InChI

InChI=1S/C23H23N7O2/c1-25-19(31)13-29-11-16(12-29)30-23-20(22(24)26-14-27-23)21(28-30)15-7-9-18(10-8-15)32-17-5-3-2-4-6-17/h2-10,14,16H,11-13H2,1H3,(H,25,31)(H2,24,26,27)