ethyl 2-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanylethanoate Openeye Name: ethyl 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanylacetate CAS Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanylacetate Traditional Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]acetic acid ethyl ester Formula: C11H12F3NO2S MolecularWeight: 279.27869

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=C(C=C1)C(F)(F)F)N

Isomeric SMILES

CCOC(=O)CSC1=C(C=C(C=C1)C(F)(F)F)N

InChI

InChI=1S/C11H12F3NO2S/c1-2-17-10(16)6-18-9-4-3-7(5-8(9)15)11(12,13)14/h3-5H,2,6,15H2,1H3