methyl 1-[3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[3-(1-tert-butyl-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxylate CAS Name: 1-[3-(1-tert-butyl-6-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(1-tert-butyl-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(1-tert-butyl-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]isonipecotic acid methyl ester Formula: C20H29N5O4 MolecularWeight: 403.47536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C20H29N5O4/c1-13-22-17-15(12-21-25(17)20(2,3)4)18(27)24(13)11-8-16(26)23-9-6-14(7-10-23)19(28)29-5/h12,14H,6-11H2,1-5H3