[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [1-(difluoromethyl)-2-benzimidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid [1-(difluoromethyl)benzimidazol-2-yl]methyl ester Formula: C21H21F2N3O5S MolecularWeight: 465.470346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=NC4=CC=CC=C4N3C(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=NC4=CC=CC=C4N3C(F)F

InChI

InChI=1S/C21H21F2N3O5S/c1-14-6-7-15(32(28,29)25-8-10-30-11-9-25)12-16(14)20(27)31-13-19-24-17-4-2-3-5-18(17)26(19)21(22)23/h2-7,12,21H,8-11,13H2,1H3