(5-ethanoyl-2-ethoxy-phenyl)methyl 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]ethanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 2-[2-(3-fluorophenyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-fluorophenyl)-4-thiazolyl]acetic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(3-fluorophenyl)thiazol-4-yl]acetic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C22H20FNO4S MolecularWeight: 413.461903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CC2=CSC(=N2)C3=CC(=CC=C3)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CC2=CSC(=N2)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H20FNO4S/c1-3-27-20-8-7-15(14(2)25)9-17(20)12-28-21(26)11-19-13-29-22(24-19)16-5-4-6-18(23)10-16/h4-10,13H,3,11-12H2,1-2H3