ethyl 4-[4-[(4-chlorophenyl)methyl-methylsulfonyl-amino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(4-chlorophenyl)methyl-methylsulfonyl-amino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(4-chlorophenyl)methyl-methylsulfonyl-amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(4-chlorophenyl)methyl-methylsulfonylamino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4-chlorophenyl)methyl-methylsulfonylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(4-chlorobenzyl)-mesyl-amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H26ClN3O5S MolecularWeight: 479.97694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC3=CC=C(C=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C22H26ClN3O5S/c1-3-31-22(28)25-14-12-24(13-15-25)21(27)18-6-10-20(11-7-18)26(32(2,29)30)16-17-4-8-19(23)9-5-17/h4-11H,3,12-16H2,1-2H3