ethyl 4-[2-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[3-[(4-bromophenyl)sulfonylamino]-1-oxopropyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-[(4-bromophenyl)sulfonylamino]propanoylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-(brosylamino)propanoylamino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H27BrN4O6S MolecularWeight: 567.45268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H27BrN4O6S/c1-2-34-23(31)28-15-13-27(14-16-28)22(30)19-5-3-4-6-20(19)26-21(29)11-12-25-35(32,33)18-9-7-17(24)8-10-18/h3-10,25H,2,11-16H2,1H3,(H,26,29)