(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl 2,6-bis(fluoranyl)benzoate

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl 2,6-bis(fluoranyl)benzoate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C21H21F2N3O5S MolecularWeight: 465.470346

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C=CC=C4F)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C=CC=C4F)F

InChI

InChI=1S/C21H21F2N3O5S/c1-2-26-18-7-6-14(32(28,29)25-8-10-30-11-9-25)12-17(18)24-19(26)13-31-21(27)20-15(22)4-3-5-16(20)23/h3-7,12H,2,8-11,13H2,1H3