cyclohexylmethyl 3-(1-tert-butyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxylate

Systemtic Name: cyclohexylmethyl 3-(1-tert-butyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxylate Openeye Name: cyclohexylmethyl 3-(1-tert-butyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxylate CAS Name: 3-(1-tert-butyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-1-azetidinecarboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 3-(1-tert-butyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxylate Traditional Name: 3-(1-tert-butyl-4-keto-2H-pyrazolo[3,4-d]pyrimidin-6-yl)azetidine-1-carboxylic acid cyclohexylmethyl ester Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=NC(=NC(=O)C2=CN1)C3CN(C3)C(=O)OCC4CCCCC4

Isomeric SMILES

CC(C)(C)N1C2=NC(=NC(=O)C2=CN1)C3CN(C3)C(=O)OCC4CCCCC4

InChI

InChI=1S/C20H29N5O3/c1-20(2,3)25-17-15(9-21-25)18(26)23-16(22-17)14-10-24(11-14)19(27)28-12-13-7-5-4-6-8-13/h9,13-14,21H,4-8,10-12H2,1-3H3