N-[2,5-bis(fluoranyl)phenyl]-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,5-difluorophenyl)-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2,5-difluorophenyl)-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2,5-difluorophenyl)-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2,5-difluorophenyl)-2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]acetamide Formula: C21H22F2N4O4S2 MolecularWeight: 496.550586

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)NC4=C(C=CC(=C4)F)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)NC4=C(C=CC(=C4)F)F

InChI

InChI=1S/C21H22F2N4O4S2/c1-2-27-19-6-4-15(33(29,30)26-7-9-31-10-8-26)12-18(19)25-21(27)32-13-20(28)24-17-11-14(22)3-5-16(17)23/h3-6,11-12H,2,7-10,13H2,1H3,(H,24,28)