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

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-thiophen-2-yl-1,3-thiazole-4-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-(2-thienyl)thiazole-4-carboxylate CAS Name: 2-thiophen-2-yl-4-thiazolecarboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-thiophen-2-yl-1,3-thiazole-4-carboxylate Traditional Name: 2-(2-thienyl)thiazole-4-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C13H11N3O3S2 MolecularWeight: 321.37474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=CS2)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CSC(=C1)C2=NC(=CS2)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C13H11N3O3S2/c14-4-2-5-15-11(17)7-19-13(18)9-8-21-12(16-9)10-3-1-6-20-10/h1,3,6,8H,2,5,7H2,(H,15,17)