tert-butyl 4-[2-methyl-5-[(phenylmethyl)sulfamoyl]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-methyl-5-[(phenylmethyl)sulfamoyl]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-(benzylsulfamoyl)-2-methyl-benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-methyl-5-[(phenylmethyl)sulfamoyl]phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-(benzylsulfamoyl)-2-methylbenzoyl]piperazine-1-carboxylate Traditional Name: 4-[5-(benzylsulfamoyl)-2-methyl-benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H31N3O5S/c1-18-10-11-20(33(30,31)25-17-19-8-6-5-7-9-19)16-21(18)22(28)26-12-14-27(15-13-26)23(29)32-24(2,3)4/h5-11,16,25H,12-15,17H2,1-4H3