(phenylmethyl) 4-[2-bromoethyl-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-bromoethyl-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]piperazine-1-carboxylate Openeye Name: benzyl 4-[2-bromoethyl(tert-butoxycarbonyl)sulfamoyl]piperazine-1-carboxylate CAS Name: 4-[2-bromoethyl-[(2-methylpropan-2-yl)oxy-oxomethyl]sulfamoyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-bromoethyl-[(2-methylpropan-2-yl)oxycarbonyl]sulfamoyl]piperazine-1-carboxylate Traditional Name: 4-[2-bromoethyl(tert-butoxycarbonyl)sulfamoyl]piperazine-1-carboxylic acid benzyl ester Formula: C19H28BrN3O6S MolecularWeight: 506.41112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCBr)S(=O)(=O)N1CCN(CC1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(CCBr)S(=O)(=O)N1CCN(CC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H28BrN3O6S/c1-19(2,3)29-18(25)23(10-9-20)30(26,27)22-13-11-21(12-14-22)17(24)28-15-16-7-5-4-6-8-16/h4-8H,9-15H2,1-3H3