N-tert-butyl-3-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-tert-butyl-3-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-tert-butyl-3-(4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-tert-butyl-3-(4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-tert-butyl-3-(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-tert-butyl-3-(4-keto-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CCN1C=NC2=C(C1=O)C=NN2C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CCN1C=NC2=C(C1=O)C=NN2C3=CC=CC=C3

InChI

InChI=1S/C18H21N5O2/c1-18(2,3)21-15(24)9-10-22-12-19-16-14(17(22)25)11-20-23(16)13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,21,24)