[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(4-fluorophenyl)-1,3-thiazole-4-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-(4-fluorophenyl)thiazole-4-carboxylate CAS Name: 2-(4-fluorophenyl)-4-thiazolecarboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-(4-fluorophenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-fluorophenyl)thiazole-4-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H12FN3O3S MolecularWeight: 333.337483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CS2)C(=O)OCC(=O)NCCC#N)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CS2)C(=O)OCC(=O)NCCC#N)F

InChI

InChI=1S/C15H12FN3O3S/c16-11-4-2-10(3-5-11)14-19-12(9-23-14)15(21)22-8-13(20)18-7-1-6-17/h2-5,9H,1,7-8H2,(H,18,20)