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

Systemtic Name: tert-butyl 4-[5-(cyclopropylsulfamoyl)-2-methyl-phenyl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-(cyclopropylsulfamoyl)-2-methyl-benzoyl]piperazine-1-carboxylate CAS Name: 4-[[5-(cyclopropylsulfamoyl)-2-methylphenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-(cyclopropylsulfamoyl)-2-methylbenzoyl]piperazine-1-carboxylate Traditional Name: 4-[5-(cyclopropylsulfamoyl)-2-methyl-benzoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H29N3O5S/c1-14-5-8-16(29(26,27)21-15-6-7-15)13-17(14)18(24)22-9-11-23(12-10-22)19(25)28-20(2,3)4/h5,8,13,15,21H,6-7,9-12H2,1-4H3