4-[[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]carbonyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]carbonyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-carbonyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[2-[(4-bromophenyl)methylthio]-4,5-dihydroimidazol-1-yl]-oxomethyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[2-[(4-bromophenyl)methylsulfanyl]-4,5-dihydroimidazole-1-carbonyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[2-[(4-bromobenzyl)thio]-2-imidazoline-1-carbonyl]-N,N-diethyl-benzenesulfonamide Formula: C21H24BrN3O3S2 MolecularWeight: 510.46756

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN=C2SCC3=CC=C(C=C3)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN=C2SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H24BrN3O3S2/c1-3-24(4-2)30(27,28)19-11-7-17(8-12-19)20(26)25-14-13-23-21(25)29-15-16-5-9-18(22)10-6-16/h5-12H,3-4,13-15H2,1-2H3