2-[(2-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 2-[(2-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide Openeye Name: 2-[(2-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(2-furylmethyl)benzimidazole-5-sulfonamide CAS Name: 2-[(2-bromophenyl)methylthio]-N,N-diethyl-1-(2-furanylmethyl)-5-benzimidazolesulfonamide IUPAC Name: 2-[(2-bromophenyl)methylsulfanyl]-N,N-diethyl-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide Traditional Name: 2-[(2-bromobenzyl)thio]-N,N-diethyl-1-(2-furfuryl)benzimidazole-5-sulfonamide Formula: C23H24BrN3O3S2 MolecularWeight: 534.48896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3Br)CC4=CC=CO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=CC=C3Br)CC4=CC=CO4

InChI

InChI=1S/C23H24BrN3O3S2/c1-3-26(4-2)32(28,29)19-11-12-22-21(14-19)25-23(27(22)15-18-9-7-13-30-18)31-16-17-8-5-6-10-20(17)24/h5-14H,3-4,15-16H2,1-2H3