tert-butyl 4-[[4-(dimethylsulfamoyl)-2-iodanyl-phenyl]carbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-(dimethylsulfamoyl)-2-iodanyl-phenyl]carbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[4-(dimethylsulfamoyl)-2-iodo-phenyl]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[4-(dimethylsulfamoyl)-2-iodoanilino]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-(dimethylsulfamoyl)-2-iodophenyl]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[4-(dimethylsulfamoyl)-2-iodo-phenyl]carbamoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C18H27IN4O5S MolecularWeight: 538.40025

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)N(C)C)I

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)S(=O)(=O)N(C)C)I

InChI

InChI=1S/C18H27IN4O5S/c1-18(2,3)28-17(25)23-10-8-22(9-11-23)16(24)20-15-7-6-13(12-14(15)19)29(26,27)21(4)5/h6-7,12H,8-11H2,1-5H3,(H,20,24)