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

Systemtic Name: 3-(1-cyclohexyl-3-methyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-(phenylmethyl)azetidine-1-carboxamide Openeye Name: N-benzyl-3-(1-cyclohexyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxamide CAS Name: 3-(1-cyclohexyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-(phenylmethyl)-1-azetidinecarboxamide IUPAC Name: N-benzyl-3-(1-cyclohexyl-3-methyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxamide Traditional Name: N-benzyl-3-(1-cyclohexyl-4-keto-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxamide Formula: C23H28N6O2 MolecularWeight: 420.50742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC(=NC2=O)C3CN(C3)C(=O)NCC4=CC=CC=C4)N(N1)C5CCCCC5

Isomeric SMILES

CC1=C2C(=NC(=NC2=O)C3CN(C3)C(=O)NCC4=CC=CC=C4)N(N1)C5CCCCC5

InChI

InChI=1S/C23H28N6O2/c1-15-19-21(29(27-15)18-10-6-3-7-11-18)25-20(26-22(19)30)17-13-28(14-17)23(31)24-12-16-8-4-2-5-9-16/h2,4-5,8-9,17-18,27H,3,6-7,10-14H2,1H3,(H,24,31)