1-(2,2-dimethylpropyl)-3-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidine-6-carbonitrile

Systemtic Name: 1-(2,2-dimethylpropyl)-3-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidine-6-carbonitrile Openeye Name: 1-(2,2-dimethylpropyl)-3-oxo-2H-pyrazolo[3,4-d]pyrimidine-6-carbonitrile CAS Name: 1-(2,2-dimethylpropyl)-3-oxo-2H-pyrazolo[3,4-d]pyrimidine-6-carbonitrile IUPAC Name: 1-(2,2-dimethylpropyl)-3-oxo-2H-pyrazolo[3,4-d]pyrimidine-6-carbonitrile Traditional Name: 3-keto-1-neopentyl-2H-pyrazolo[3,4-d]pyrimidine-6-carbonitrile Formula: C11H13N5O MolecularWeight: 231.25382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C2=NC(=NC=C2C(=O)N1)C#N

Isomeric SMILES

CC(C)(C)CN1C2=NC(=NC=C2C(=O)N1)C#N

InChI

InChI=1S/C11H13N5O/c1-11(2,3)6-16-9-7(10(17)15-16)5-13-8(4-12)14-9/h5H,6H2,1-3H3,(H,15,17)