N-cyano-3-(1-cyclohexyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N'-(4-fluorophenyl)azetidine-1-carboximidamide

Systemtic Name: N-cyano-3-(1-cyclohexyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N'-(4-fluorophenyl)azetidine-1-carboximidamide Openeye Name: N-cyano-3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N'-(4-fluorophenyl)azetidine-1-carboxamidine CAS Name: N-cyano-3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N'-(4-fluorophenyl)-1-azetidinecarboximidamide IUPAC Name: N-cyano-3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N'-(4-fluorophenyl)azetidine-1-carboximidamide Traditional Name: N-cyano-3-(1-cyclohexyl-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N'-(4-fluorophenyl)azetidine-1-carboxamidine Formula: C22H23FN8O MolecularWeight: 434.469423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=NC(=NC(=O)C3=CN2)C4CN(C4)C(=NC5=CC=C(C=C5)F)NC#N

Isomeric SMILES

C1CCC(CC1)N2C3=NC(=NC(=O)C3=CN2)C4CN(C4)C(=NC5=CC=C(C=C5)F)NC#N

InChI

InChI=1S/C22H23FN8O/c23-15-6-8-16(9-7-15)27-22(25-13-24)30-11-14(12-30)19-28-20-18(21(32)29-19)10-26-31(20)17-4-2-1-3-5-17/h6-10,14,17,26H,1-5,11-12H2,(H,25,27)