3-azanyl-5-[5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[5-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]pentyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pentyl]-1H-pyrazole-4-carbonitrile Formula: C20H21N9 MolecularWeight: 387.44104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C20H21N9/c21-11-15-17(27-28-18(15)22)9-5-2-6-10-23-19-16-12-26-29(20(16)25-13-24-19)14-7-3-1-4-8-14/h1,3-4,7-8,12-13H,2,5-6,9-10H2,(H3,22,27,28)(H,23,24,25)