4-(4-fluoranyl-3-methyl-phenyl)-5-methyl-1,3-thiazole-2-carboxylate

Systemtic Name: 4-(4-fluoranyl-3-methyl-phenyl)-5-methyl-1,3-thiazole-2-carboxylate Openeye Name: 4-(4-fluoro-3-methyl-phenyl)-5-methyl-thiazole-2-carboxylate CAS Name: 4-(4-fluoro-3-methylphenyl)-5-methyl-2-thiazolecarboxylate IUPAC Name: 4-(4-fluoro-3-methylphenyl)-5-methyl-1,3-thiazole-2-carboxylate Traditional Name: 4-(4-fluoro-3-methyl-phenyl)-5-methyl-thiazole-2-carboxylate Formula: C12H9FNO2S- MolecularWeight: 250.268763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C(SC(=N2)C(=O)[O-])C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C(SC(=N2)C(=O)[O-])C)F

InChI

InChI=1S/C12H10FNO2S/c1-6-5-8(3-4-9(6)13)10-7(2)17-11(14-10)12(15)16/h3-5H,1-2H3,(H,15,16)/p-1