2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)ethanone

Systemtic Name: 2-(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)ethanone Openeye Name: 2-(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)ethanone CAS Name: 2-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]thio]-1-(4-fluorophenyl)ethanone IUPAC Name: 2-(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)ethanone Traditional Name: 2-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)thio]-1-(4-fluorophenyl)ethanone Formula: C21H22FN3O4S2 MolecularWeight: 463.545483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22FN3O4S2/c1-2-25-19-8-7-17(31(27,28)24-9-11-29-12-10-24)13-18(19)23-21(25)30-14-20(26)15-3-5-16(22)6-4-15/h3-8,13H,2,9-12,14H2,1H3