tert-butyl 4-[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(4-fluorophenyl)sulfonylamino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(4-fluorophenyl)sulfonylamino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(4-fluorophenyl)sulfonylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(4-fluorophenyl)sulfonylamino]benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H26FN3O5S MolecularWeight: 463.522343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O5S/c1-22(2,3)31-21(28)26-14-12-25(13-15-26)20(27)16-4-8-18(9-5-16)24-32(29,30)19-10-6-17(23)7-11-19/h4-11,24H,12-15H2,1-3H3