N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(5-chloro-2-morpholino-phenyl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(5-chloro-2-morpholin-4-ylphenyl)-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-(5-chloro-2-morpholino-phenyl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C18H19ClN6O3 MolecularWeight: 402.83486

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

InChI

InChI=1S/C18H19ClN6O3/c1-23-17-13(9-21-23)18(27)25(11-20-17)10-16(26)22-14-8-12(19)2-3-15(14)24-4-6-28-7-5-24/h2-3,8-9,11H,4-7,10H2,1H3,(H,22,26)