propyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4-carboxylate

Systemtic Name: propyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4-carboxylate Openeye Name: propyl 3-[3,5-bis(trifluoromethyl)phenyl]isothiazole-4-carboxylate CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-4-isothiazolecarboxylic acid propyl ester IUPAC Name: propyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4-carboxylate Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]isothiazole-4-carboxylic acid propyl ester Formula: C15H11F6NO2S MolecularWeight: 383.308759

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CSN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCOC(=O)C1=CSN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H11F6NO2S/c1-2-3-24-13(23)11-7-25-22-12(11)8-4-9(14(16,17)18)6-10(5-8)15(19,20)21/h4-7H,2-3H2,1H3