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

Systemtic Name: 3-[2-cyclopentyl-6-(pyridin-3-ylmethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]-2-oxidanylidene-1,3-dihydroindole-5-carbonitrile Openeye Name: 3-[2-cyclopentyl-6-(3-pyridylmethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]-2-oxo-indoline-5-carbonitrile CAS Name: 3-[2-cyclopentyl-6-(3-pyridinylmethylamino)-4-pyrazolo[3,4-d]pyrimidinyl]-2-oxo-1,3-dihydroindole-5-carbonitrile IUPAC Name: 3-[2-cyclopentyl-6-(pyridin-3-ylmethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]-2-oxo-1,3-dihydroindole-5-carbonitrile Traditional Name: 3-[2-cyclopentyl-6-(3-pyridylmethylamino)pyrazolo[3,4-d]pyrimidin-4-yl]-2-keto-indoline-5-carbonitrile Formula: C25H22N8O MolecularWeight: 450.49518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=C3C(=NC(=NC3=N2)NCC4=CN=CC=C4)C5C6=C(C=CC(=C6)C#N)NC5=O

Isomeric SMILES

C1CCC(C1)N2C=C3C(=NC(=NC3=N2)NCC4=CN=CC=C4)C5C6=C(C=CC(=C6)C#N)NC5=O

InChI

InChI=1S/C25H22N8O/c26-11-15-7-8-20-18(10-15)21(24(34)29-20)22-19-14-33(17-5-1-2-6-17)32-23(19)31-25(30-22)28-13-16-4-3-9-27-12-16/h3-4,7-10,12,14,17,21H,1-2,5-6,13H2,(H,29,34)(H,28,31,32)