dimethyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4,5-dicarboxylate

Systemtic Name: dimethyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4,5-dicarboxylate Openeye Name: dimethyl 3-[3,5-bis(trifluoromethyl)phenyl]isothiazole-4,5-dicarboxylate CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]isothiazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4,5-dicarboxylate Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]isothiazole-4,5-dicarboxylic acid dimethyl ester Formula: C15H9F6NO4S MolecularWeight: 413.291679

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C15H9F6NO4S/c1-25-12(23)9-10(22-27-11(9)13(24)26-2)6-3-7(14(16,17)18)5-8(4-6)15(19,20)21/h3-5H,1-2H3