ethyl 4-[5-(dimethylsulfamoyl)-2-iodanyl-phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-(dimethylsulfamoyl)-2-iodanyl-phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[5-(dimethylsulfamoyl)-2-iodo-benzoyl]piperazine-1-carboxylate CAS Name: 4-[[5-(dimethylsulfamoyl)-2-iodophenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(dimethylsulfamoyl)-2-iodobenzoyl]piperazine-1-carboxylate Traditional Name: 4-[5-(dimethylsulfamoyl)-2-iodo-benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22IN3O5S MolecularWeight: 495.33245

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22IN3O5S/c1-4-25-16(22)20-9-7-19(8-10-20)15(21)13-11-12(5-6-14(13)17)26(23,24)18(2)3/h5-6,11H,4,7-10H2,1-3H3