(phenylmethyl) 2-(3-cyclopropyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(3-cyclopropyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate Openeye Name: benzyl 2-(3-cyclopropyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate CAS Name: 2-(3-cyclopropyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-cyclopropyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate Traditional Name: 2-(3-cyclopropyl-7-keto-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C3=CC(=O)N4C(=N3)C(=CN4)C5CC5

Isomeric SMILES

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C3=CC(=O)N4C(=N3)C(=CN4)C5CC5

InChI

InChI=1S/C21H22N4O3/c26-19-11-17(23-20-16(15-8-9-15)12-22-25(19)20)18-7-4-10-24(18)21(27)28-13-14-5-2-1-3-6-14/h1-3,5-6,11-12,15,18,22H,4,7-10,13H2