tert-butyl 3-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]pyrrolidine-1-carboxylate CAS Name: 3-[6-oxo-3-(2-phenyl-3-pyrazolo[1,5-a]pyridinyl)-1-pyridazinyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]pyrrolidine-1-carboxylate Traditional Name: 3-[6-keto-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5

InChI

InChI=1S/C26H27N5O3/c1-26(2,3)34-25(33)29-16-14-19(17-29)31-22(32)13-12-20(27-31)23-21-11-7-8-15-30(21)28-24(23)18-9-5-4-6-10-18/h4-13,15,19H,14,16-17H2,1-3H3