2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-1-ethyl-benzimidazole-5-sulfonamide Formula: C16H15ClFN3O2S2 MolecularWeight: 399.890603

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H15ClFN3O2S2/c1-2-21-15-7-6-10(25(19,22)23)8-14(15)20-16(21)24-9-11-12(17)4-3-5-13(11)18/h3-8H,2,9H2,1H3,(H2,19,22,23)