N-[2,6-bis(fluoranyl)phenyl]-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,6-bis(fluoranyl)phenyl]-2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-difluorophenyl)-2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2,6-difluorophenyl)-2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2,6-difluorophenyl)-2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2,6-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=C4F)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1SCC(=O)NC4=C(C=CC=C4F)F

InChI

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