ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(2,5-dimethylphenyl)sulfonylamino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2,5-dimethylphenyl)sulfonylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(2,5-dimethylphenyl)sulfonylamino]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)NS(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

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