ethyl 4-azanyl-3-[3-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylate

Systemtic Name: ethyl 4-azanyl-3-[3-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylate Openeye Name: ethyl 4-amino-3-[3-(trifluoromethyl)phenyl]isothiazole-5-carboxylate CAS Name: 4-amino-3-[3-(trifluoromethyl)phenyl]-5-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-3-[3-(trifluoromethyl)phenyl]-1,2-thiazole-5-carboxylate Traditional Name: 4-amino-3-[3-(trifluoromethyl)phenyl]isothiazole-5-carboxylic acid ethyl ester Formula: C13H11F3N2O2S MolecularWeight: 316.29885

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NS1)C2=CC(=CC=C2)C(F)(F)F)N

Isomeric SMILES

CCOC(=O)C1=C(C(=NS1)C2=CC(=CC=C2)C(F)(F)F)N

InChI

InChI=1S/C13H11F3N2O2S/c1-2-20-12(19)11-9(17)10(18-21-11)7-4-3-5-8(6-7)13(14,15)16/h3-6H,2,17H2,1H3