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

Systemtic Name: methyl 1-[3-(6-methyl-4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[3-(6-methyl-4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxylate CAS Name: 1-[3-(6-methyl-4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(6-methyl-4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(4-keto-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanoyl]isonipecotic acid methyl ester Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(=O)N4CCC(CC4)C(=O)OC

Isomeric SMILES

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=O)N1CCC(=O)N4CCC(CC4)C(=O)OC

InChI

InChI=1S/C22H25N5O4/c1-15-24-20-18(14-23-27(20)17-6-4-3-5-7-17)21(29)26(15)13-10-19(28)25-11-8-16(9-12-25)22(30)31-2/h3-7,14,16H,8-13H2,1-2H3