3-[[2-(4-bromanylphenoxy)ethanoylamino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: 3-[[2-(4-bromanylphenoxy)ethanoylamino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: 3-[[[2-(4-bromophenoxy)acetyl]amino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: 3-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-oxomethyl]-N,N-dimethyl-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: 3-[[[2-(4-bromophenoxy)acetyl]amino]carbamoyl]-N,N-dimethyl-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: 3-[[[2-(4-bromophenoxy)acetyl]amino]carbamoyl]-N,N-dimethyl-4-pyrrolidino-benzenesulfonamide Formula: C21H25BrN4O5S MolecularWeight: 525.416

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NNC(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NNC(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN4O5S/c1-25(2)32(29,30)17-9-10-19(26-11-3-4-12-26)18(13-17)21(28)24-23-20(27)14-31-16-7-5-15(22)6-8-16/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,23,27)(H,24,28)