[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(3-methoxyphenyl)thiazol-4-yl]methyl 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid [2-(3-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid [2-(3-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C22H21FN2O6S2 MolecularWeight: 492.540343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H21FN2O6S2/c1-29-18-4-2-3-15(11-18)21-24-17(14-32-21)13-31-22(26)16-5-6-19(23)20(12-16)33(27,28)25-7-9-30-10-8-25/h2-6,11-12,14H,7-10,13H2,1H3