2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(3-fluorophenyl)ethanamide Openeye Name: 2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-N-(3-fluorophenyl)acetamide CAS Name: 2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-(3-fluorophenyl)acetamide Traditional Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-N-(3-fluorophenyl)acetamide Formula: C21H23FN4O4S2 MolecularWeight: 478.560123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN4O4S2/c1-2-26-19-7-6-17(32(28,29)25-8-10-30-11-9-25)13-18(19)24-21(26)31-14-20(27)23-16-5-3-4-15(22)12-16/h3-7,12-13H,2,8-11,14H2,1H3,(H,23,27)