ethyl 4-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[methyl(p-tolylsulfonyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[methyl(tosyl)amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H27N3O5S/c1-4-30-22(27)25-15-13-24(14-16-25)21(26)18-7-9-19(10-8-18)23(3)31(28,29)20-11-5-17(2)6-12-20/h5-12H,4,13-16H2,1-3H3