tert-butyl 4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-cyclopropyl-2-phenylpyrazole-3-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C22H28N4O3/c1-22(2,3)29-21(28)25-13-11-24(12-14-25)20(27)19-15-18(16-9-10-16)23-26(19)17-7-5-4-6-8-17/h4-8,15-16H,9-14H2,1-3H3