ethyl 2-(decanoylamino)-4-(4-fluorophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(decanoylamino)-4-(4-fluorophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(decanoylamino)-4-(4-fluorophenyl)thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-(1-oxodecylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(decanoylamino)-4-(4-fluorophenyl)thiophene-3-carboxylate Traditional Name: 2-(caprylamino)-4-(4-fluorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C23H30FNO3S MolecularWeight: 419.552603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)F)C(=O)OCC

Isomeric SMILES

CCCCCCCCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)F)C(=O)OCC

InChI

InChI=1S/C23H30FNO3S/c1-3-5-6-7-8-9-10-11-20(26)25-22-21(23(27)28-4-2)19(16-29-22)17-12-14-18(24)15-13-17/h12-16H,3-11H2,1-2H3,(H,25,26)