tert-butyl 4-[3-(cyclopentylcarbamoyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(cyclopentylcarbamoyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-(cyclopentylcarbamoyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate CAS Name: 4-[3-[(cyclopentylamino)-oxomethyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(cyclopentylcarbamoyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate Traditional Name: 4-[3-(cyclopentylcarbamoyl)-7-keto-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H31N5O4 MolecularWeight: 429.51264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC(=O)N3C(=N2)C(=CN3)C(=O)NC4CCCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=CC(=O)N3C(=N2)C(=CN3)C(=O)NC4CCCC4

InChI

InChI=1S/C22H31N5O4/c1-22(2,3)31-21(30)26-10-8-14(9-11-26)17-12-18(28)27-19(25-17)16(13-23-27)20(29)24-15-6-4-5-7-15/h12-15,23H,4-11H2,1-3H3,(H,24,29)