3-[[3-(3-bromophenyl)propanoylamino]carbamoyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[[3-(3-bromophenyl)propanoylamino]carbamoyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[[3-(3-bromophenyl)propanoylamino]carbamoyl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[[[3-(3-bromophenyl)-1-oxopropyl]hydrazo]-oxomethyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[[3-(3-bromophenyl)propanoylamino]carbamoyl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[[3-(3-bromophenyl)propanoylamino]carbamoyl]-N,N-diethyl-benzenesulfonamide Formula: C20H24BrN3O4S MolecularWeight: 482.39126

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC2=CC(=CC=C2)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC2=CC(=CC=C2)Br

InChI

InChI=1S/C20H24BrN3O4S/c1-3-24(4-2)29(27,28)18-10-6-8-16(14-18)20(26)23-22-19(25)12-11-15-7-5-9-17(21)13-15/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,22,25)(H,23,26)