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

Systemtic Name: tert-butyl 4-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[methyl(p-tolylsulfonyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[methyl(tosyl)amino]benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H31N3O5S/c1-18-6-12-21(13-7-18)33(30,31)25(5)20-10-8-19(9-11-20)22(28)26-14-16-27(17-15-26)23(29)32-24(2,3)4/h6-13H,14-17H2,1-5H3