ethyl 1-[2-(3-cyano-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(3-cyano-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(3-cyano-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(3-cyano-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-cyano-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-cyano-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)acetyl]isonipecotic acid ethyl ester Formula: C18H21N5O4 MolecularWeight: 371.39044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CC2=C(N=C3C(=CNN3C2=O)C#N)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CC2=C(N=C3C(=CNN3C2=O)C#N)C

InChI

InChI=1S/C18H21N5O4/c1-3-27-18(26)12-4-6-22(7-5-12)15(24)8-14-11(2)21-16-13(9-19)10-20-23(16)17(14)25/h10,12,20H,3-8H2,1-2H3