3-[6-(butylamino)-2-cyclopentyl-pyrazolo[3,4-d]pyrimidin-4-yl]-2-oxidanylidene-1,3-dihydroindole-5-carbonitrile

Systemtic Name: 3-[6-(butylamino)-2-cyclopentyl-pyrazolo[3,4-d]pyrimidin-4-yl]-2-oxidanylidene-1,3-dihydroindole-5-carbonitrile Openeye Name: 3-[6-(butylamino)-2-cyclopentyl-pyrazolo[3,4-d]pyrimidin-4-yl]-2-oxo-indoline-5-carbonitrile CAS Name: 3-[6-(butylamino)-2-cyclopentyl-4-pyrazolo[3,4-d]pyrimidinyl]-2-oxo-1,3-dihydroindole-5-carbonitrile IUPAC Name: 3-[6-(butylamino)-2-cyclopentylpyrazolo[3,4-d]pyrimidin-4-yl]-2-oxo-1,3-dihydroindole-5-carbonitrile Traditional Name: 3-[6-(butylamino)-2-cyclopentyl-pyrazolo[3,4-d]pyrimidin-4-yl]-2-keto-indoline-5-carbonitrile Formula: C23H25N7O MolecularWeight: 415.4909

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=NN(C=C2C(=N1)C3C4=C(C=CC(=C4)C#N)NC3=O)C5CCCC5

Isomeric SMILES

CCCCNC1=NC2=NN(C=C2C(=N1)C3C4=C(C=CC(=C4)C#N)NC3=O)C5CCCC5

InChI

InChI=1S/C23H25N7O/c1-2-3-10-25-23-27-20(17-13-30(29-21(17)28-23)15-6-4-5-7-15)19-16-11-14(12-24)8-9-18(16)26-22(19)31/h8-9,11,13,15,19H,2-7,10H2,1H3,(H,26,31)(H,25,28,29)