4-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[2-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[2-[(2-chloro-4-fluorophenyl)methylthio]-1-ethyl-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[2-[(2-chloro-4-fluorophenyl)methylsulfanyl]-1-ethylbenzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[2-[(2-chloro-4-fluoro-benzyl)thio]-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine Formula: C20H21ClFN3O3S2 MolecularWeight: 469.980443

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C20H21ClFN3O3S2/c1-2-25-19-6-5-16(30(26,27)24-7-9-28-10-8-24)12-18(19)23-20(25)29-13-14-3-4-15(22)11-17(14)21/h3-6,11-12H,2,7-10,13H2,1H3