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

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C17H17ClFN3O2S2 MolecularWeight: 413.917183

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H17ClFN3O2S2/c1-2-8-22-16-7-6-11(26(20,23)24)9-15(16)21-17(22)25-10-12-13(18)4-3-5-14(12)19/h3-7,9H,2,8,10H2,1H3,(H2,20,23,24)