3-[5-(4-chlorophenyl)-4-oxidanylidene-6-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-1-yl]benzenecarboximidamide

Systemtic Name: 3-[5-(4-chlorophenyl)-4-oxidanylidene-6-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-1-yl]benzenecarboximidamide Openeye Name: 3-[5-(4-chlorophenyl)-4-oxo-6-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-1-yl]benzamidine CAS Name: 3-[5-(4-chlorophenyl)-4-oxo-6-(2-pyrazinyl)-1-pyrazolo[3,4-d]pyrimidinyl]benzenecarboximidamide IUPAC Name: 3-[5-(4-chlorophenyl)-4-oxo-6-pyrazin-2-ylpyrazolo[3,4-d]pyrimidin-1-yl]benzenecarboximidamide Traditional Name: 3-[5-(4-chlorophenyl)-4-keto-6-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-1-yl]benzamidine Formula: C22H15ClN8O MolecularWeight: 442.8605

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C3=C(C=N2)C(=O)N(C(=N3)C4=NC=CN=C4)C5=CC=C(C=C5)Cl)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)N2C3=C(C=N2)C(=O)N(C(=N3)C4=NC=CN=C4)C5=CC=C(C=C5)Cl)C(=N)N

InChI

InChI=1S/C22H15ClN8O/c23-14-4-6-15(7-5-14)30-21(18-12-26-8-9-27-18)29-20-17(22(30)32)11-28-31(20)16-3-1-2-13(10-16)19(24)25/h1-12H,(H3,24,25)