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

Systemtic Name: ethyl 4-azanyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-amino-2-thioxo-3-[3-(trifluoromethyl)phenyl]thiazole-5-carboxylate CAS Name: 4-amino-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-2-thioxo-3-[3-(trifluoromethyl)phenyl]-4-thiazoline-5-carboxylic acid ethyl ester Formula: C13H11F3N2O2S2 MolecularWeight: 348.36385

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)S1)C2=CC=CC(=C2)C(F)(F)F)N

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)S1)C2=CC=CC(=C2)C(F)(F)F)N

InChI

InChI=1S/C13H11F3N2O2S2/c1-2-20-11(19)9-10(17)18(12(21)22-9)8-5-3-4-7(6-8)13(14,15)16/h3-6H,2,17H2,1H3