ethyl 6-oxidanylidene-5-[2-(phenylsulfonylmethyl)-1,3-thiazol-4-yl]-2-(trifluoromethyl)-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-5-[2-(phenylsulfonylmethyl)-1,3-thiazol-4-yl]-2-(trifluoromethyl)-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-[2-(benzenesulfonylmethyl)thiazol-4-yl]-6-oxo-2-(trifluoromethyl)-1H-pyridine-3-carboxylate CAS Name: 5-[2-(benzenesulfonylmethyl)-4-thiazolyl]-6-oxo-2-(trifluoromethyl)-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(benzenesulfonylmethyl)-1,3-thiazol-4-yl]-6-oxo-2-(trifluoromethyl)-1H-pyridine-3-carboxylate Traditional Name: 5-[2-(besylmethyl)thiazol-4-yl]-6-keto-2-(trifluoromethyl)-1H-pyridine-3-carboxylic acid ethyl ester Formula: C19H15F3N2O5S2 MolecularWeight: 472.45801

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)C(=C1)C2=CSC(=N2)CS(=O)(=O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)C(=C1)C2=CSC(=N2)CS(=O)(=O)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H15F3N2O5S2/c1-2-29-18(26)13-8-12(17(25)24-16(13)19(20,21)22)14-9-30-15(23-14)10-31(27,28)11-6-4-3-5-7-11/h3-9H,2,10H2,1H3,(H,24,25)