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

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C17H18N6O4/c1-10(24)20-11-4-5-14(27-3)13(6-11)21-15(25)8-23-9-18-16-12(17(23)26)7-19-22(16)2/h4-7,9H,8H2,1-3H3,(H,20,24)(H,21,25)