(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl (E)-3-(3-fluorophenyl)prop-2-enoate

Systemtic Name: (1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl (E)-3-(3-fluorophenyl)prop-2-enoate Openeye Name: (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl (E)-3-(3-fluorophenyl)prop-2-enoate CAS Name: (E)-3-(3-fluorophenyl)-2-propenoic acid [1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl (E)-3-(3-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(3-fluorophenyl)acrylic acid (1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C23H24FN3O5S MolecularWeight: 473.517163

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C=CC4=CC(=CC=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C23H24FN3O5S/c1-2-27-21-8-7-19(33(29,30)26-10-12-31-13-11-26)15-20(21)25-22(27)16-32-23(28)9-6-17-4-3-5-18(24)14-17/h3-9,14-15H,2,10-13,16H2,1H3/b9-6+