N-(2-ethanoylphenyl)-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-(2-ethanoylphenyl)-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(2-acetylphenyl)-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(2-acetylphenyl)-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(2-acetylphenyl)-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(2-acetylphenyl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)CCN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C17H17N5O3/c1-11(23)12-5-3-4-6-14(12)20-15(24)7-8-22-10-18-16-13(17(22)25)9-19-21(16)2/h3-6,9-10H,7-8H2,1-2H3,(H,20,24)