methyl 3-azanyl-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylate Openeye Name: methyl 3-amino-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylate CAS Name: 3-amino-5-[4-(trifluoromethyl)phenyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylate Traditional Name: 3-amino-5-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid methyl ester Formula: C13H10F3NO2S MolecularWeight: 301.28421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10F3NO2S/c1-19-12(18)11-9(17)6-10(20-11)7-2-4-8(5-3-7)13(14,15)16/h2-6H,17H2,1H3