2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1-methyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1-methyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-1-methyl-benzimidazole-5-sulfonamide CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-1-methyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-1-methylbenzimidazole-5-sulfonamide Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]-1-methyl-benzimidazole-5-sulfonamide Formula: C16H16FN3O3S2 MolecularWeight: 381.444943

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C16H16FN3O3S2/c1-20-14-5-4-11(25(18,21)22)8-13(14)19-16(20)24-9-10-3-6-15(23-2)12(17)7-10/h3-8H,9H2,1-2H3,(H2,18,21,22)