tert-butyl 4-[3,4-dimethyl-5-(methylsulfamoyl)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3,4-dimethyl-5-(methylsulfamoyl)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3,4-dimethyl-5-(methylsulfamoyl)benzoyl]piperazine-1-carboxylate CAS Name: 4-[[3,4-dimethyl-5-(methylsulfamoyl)phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3,4-dimethyl-5-(methylsulfamoyl)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[3,4-dimethyl-5-(methylsulfamoyl)benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O5S MolecularWeight: 411.51566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C)S(=O)(=O)NC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C)S(=O)(=O)NC)C

InChI

InChI=1S/C19H29N3O5S/c1-13-11-15(12-16(14(13)2)28(25,26)20-6)17(23)21-7-9-22(10-8-21)18(24)27-19(3,4)5/h11-12,20H,7-10H2,1-6H3