methyl 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]butanoate

Systemtic Name: methyl 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]butanoate Openeye Name: methyl 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)oxazol-2-yl]butanoate CAS Name: 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-2-oxazolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1,3-oxazol-2-yl]butanoate Traditional Name: 4-[4-(4-fluorophenyl)-5-(4-mesylphenyl)oxazol-2-yl]butyric acid methyl ester Formula: C21H20FNO5S MolecularWeight: 417.450603

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=NC(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)CCCC1=NC(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FNO5S/c1-27-19(24)5-3-4-18-23-20(14-6-10-16(22)11-7-14)21(28-18)15-8-12-17(13-9-15)29(2,25)26/h6-13H,3-5H2,1-2H3