4-azanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-3-carbonitrile

Systemtic Name: 4-azanyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-3-carbonitrile Openeye Name: 4-amino-1-phenyl-pyrazolo[3,4-d]pyrimidine-3-carbonitrile CAS Name: 4-amino-1-phenyl-3-pyrazolo[3,4-d]pyrimidinecarbonitrile IUPAC Name: 4-amino-1-phenylpyrazolo[3,4-d]pyrimidine-3-carbonitrile Traditional Name: 4-amino-1-phenyl-pyrazolo[3,4-d]pyrimidine-3-carbonitrile Formula: C12H8N6 MolecularWeight: 236.23212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8N6/c13-6-9-10-11(14)15-7-16-12(10)18(17-9)8-4-2-1-3-5-8/h1-5,7H,(H2,14,15,16)