trifluoromethyl 3-cyano-2-[(3-methoxyphenyl)carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: trifluoromethyl 3-cyano-2-[(3-methoxyphenyl)carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: trifluoromethyl 3-cyano-2-[(3-methoxybenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-cyano-2-[[(3-methoxyphenyl)-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid trifluoromethyl ester IUPAC Name: trifluoromethyl 3-cyano-2-[(3-methoxybenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-cyano-2-(m-anisoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid trifluoromethyl ester Formula: C18H14F3N3O4S MolecularWeight: 425.38167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CN(CC3)C(=O)OC(F)(F)F)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CN(CC3)C(=O)OC(F)(F)F)C#N

InChI

InChI=1S/C18H14F3N3O4S/c1-27-11-4-2-3-10(7-11)15(25)23-16-13(8-22)12-5-6-24(9-14(12)29-16)17(26)28-18(19,20)21/h2-4,7H,5-6,9H2,1H3,(H,23,25)