2-[(3-chloranyl-2-fluoranyl-phenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 2-[(3-chloranyl-2-fluoranyl-phenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide Openeye Name: 2-[(3-chloro-2-fluoro-phenyl)methylsulfanyl]-N,N-diethyl-1-(tetrahydrofuran-2-ylmethyl)benzimidazole-5-sulfonamide CAS Name: 2-[(3-chloro-2-fluorophenyl)methylthio]-N,N-diethyl-1-(2-oxolanylmethyl)-5-benzimidazolesulfonamide IUPAC Name: 2-[(3-chloro-2-fluorophenyl)methylsulfanyl]-N,N-diethyl-1-(oxolan-2-ylmethyl)benzimidazole-5-sulfonamide Traditional Name: 2-[(3-chloro-2-fluoro-benzyl)thio]-N,N-diethyl-1-(tetrahydrofurfuryl)benzimidazole-5-sulfonamide Formula: C23H27ClFN3O3S2 MolecularWeight: 512.060183

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C(C(=CC=C3)Cl)F)CC4CCCO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C(C(=CC=C3)Cl)F)CC4CCCO4

InChI

InChI=1S/C23H27ClFN3O3S2/c1-3-27(4-2)33(29,30)18-10-11-21-20(13-18)26-23(28(21)14-17-8-6-12-31-17)32-15-16-7-5-9-19(24)22(16)25/h5,7,9-11,13,17H,3-4,6,8,12,14-15H2,1-2H3