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

Systemtic Name: methyl 4-azanyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-amino-2-thioxo-3-[3-(trifluoromethyl)phenyl]thiazole-5-carboxylate CAS Name: 4-amino-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 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 methyl ester Formula: C12H9F3N2O2S2 MolecularWeight: 334.33727

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9F3N2O2S2/c1-19-10(18)8-9(16)17(11(20)21-8)7-4-2-3-6(5-7)12(13,14)15/h2-5H,16H2,1H3