2-(2-cyano-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethyl cyclohexanecarboxylate

Systemtic Name: 2-(2-cyano-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethyl cyclohexanecarboxylate Openeye Name: 2-(2-cyano-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid 2-(2-cyano-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethyl ester IUPAC Name: 2-(2-cyano-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid 2-(2-cyano-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-6-yl)ethyl ester Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C=C(N2)C#N)CCOC(=O)C3CCCCC3

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C=C(N2)C#N)CCOC(=O)C3CCCCC3

InChI

InChI=1S/C17H20N4O3/c1-11-14(7-8-24-17(23)12-5-3-2-4-6-12)16(22)21-15(19-11)9-13(10-18)20-21/h9,12,20H,2-8H2,1H3