3-(1-cyclohexyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-(phenylmethyl)azetidine-1-carboxamide

Systemtic Name: 3-(1-cyclohexyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-(phenylmethyl)azetidine-1-carboxamide Openeye Name: N-benzyl-3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxamide CAS Name: 3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-(phenylmethyl)-1-azetidinecarboxamide IUPAC Name: N-benzyl-3-(1-cyclohexyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxamide Traditional Name: N-benzyl-3-(1-cyclohexyl-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxamide Formula: C22H26N6O2 MolecularWeight: 406.48084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=NC(=NC(=O)C3=CN2)C4CN(C4)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C3=NC(=NC(=O)C3=CN2)C4CN(C4)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C22H26N6O2/c29-21-18-12-24-28(17-9-5-2-6-10-17)20(18)25-19(26-21)16-13-27(14-16)22(30)23-11-15-7-3-1-4-8-15/h1,3-4,7-8,12,16-17,24H,2,5-6,9-11,13-14H2,(H,23,30)