phenyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)methanone

Systemtic Name: phenyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)methanone Openeye Name: phenyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)methanone CAS Name: phenyl-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)methanone IUPAC Name: phenyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)methanone Traditional Name: phenyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)methanone Formula: C18H12N4O MolecularWeight: 300.31408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C3C=NN(C3=NC=N2)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C3C=NN(C3=NC=N2)C4=CC=CC=C4

InChI

InChI=1S/C18H12N4O/c23-17(13-7-3-1-4-8-13)16-15-11-21-22(18(15)20-12-19-16)14-9-5-2-6-10-14/h1-12H