5-azanyl-1-[3-(cyanomethyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[3-(cyanomethyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[3-(cyanomethyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-[3-(cyanomethyl)-1-methyl-4-pyrazolo[3,4-d]pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[3-(cyanomethyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[3-(cyanomethyl)-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C12H9N9 MolecularWeight: 279.26016

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=N1)CC#N)C(=NC=N2)N3C(=C(C=N3)C#N)N

Isomeric SMILES

CN1C2=C(C(=N1)CC#N)C(=NC=N2)N3C(=C(C=N3)C#N)N

InChI

InChI=1S/C12H9N9/c1-20-11-9(8(19-20)2-3-13)12(17-6-16-11)21-10(15)7(4-14)5-18-21/h5-6H,2,15H2,1H3