ethyl 3-methyl-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: ethyl 3-methyl-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: ethyl 3-methyl-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-methyl-6-phenyl-4-(trifluoromethyl)-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-methyl-6-phenyl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxylic acid ethyl ester Formula: C18H14F3NO2S MolecularWeight: 365.36947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C(F)(F)F)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C(F)(F)F)C3=CC=CC=C3)C

InChI

InChI=1S/C18H14F3NO2S/c1-3-24-17(23)15-10(2)14-12(18(19,20)21)9-13(22-16(14)25-15)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3