5-azanyl-3-[3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[3-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]propyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]propyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]propyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C19H19N9 MolecularWeight: 373.41446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4

InChI

InChI=1S/C19H19N9/c1-27-19-15(11-25-27)18(23-12-24-19)22-9-5-8-16-14(10-20)17(21)28(26-16)13-6-3-2-4-7-13/h2-4,6-7,11-12H,5,8-9,21H2,1H3,(H,22,23,24)