2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C18H16BrN5O3S2 MolecularWeight: 494.38534

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=NC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C18H16BrN5O3S2/c1-2-24-15-7-6-13(29(20,25)26)9-14(15)21-18(24)28-10-16-22-17(23-27-16)11-4-3-5-12(19)8-11/h3-9H,2,10H2,1H3,(H2,20,25,26)