tert-butyl 4-[[2-(2-methylpropyl)-3-oxidanylidene-6-phenyl-pyridazin-4-yl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(2-methylpropyl)-3-oxidanylidene-6-phenyl-pyridazin-4-yl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2-isobutyl-3-oxo-6-phenyl-pyridazin-4-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[[2-(2-methylpropyl)-3-oxo-6-phenyl-4-pyridazinyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(2-methylpropyl)-3-oxo-6-phenylpyridazin-4-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[(2-isobutyl-3-keto-6-phenyl-pyridazin-4-yl)methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H34N4O3 MolecularWeight: 426.55176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CC(=N1)C2=CC=CC=C2)CN3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CN1C(=O)C(=CC(=N1)C2=CC=CC=C2)CN3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H34N4O3/c1-18(2)16-28-22(29)20(15-21(25-28)19-9-7-6-8-10-19)17-26-11-13-27(14-12-26)23(30)31-24(3,4)5/h6-10,15,18H,11-14,16-17H2,1-5H3