[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3-chloro-6-fluoro-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-fluoro-1-benzothiophene-2-carboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3-chloro-6-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-fluoro-benzothiophene-2-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H10ClFN2O3S MolecularWeight: 340.757203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)SC(=C2Cl)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC2=C(C=C1F)SC(=C2Cl)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H10ClFN2O3S/c15-12-9-3-2-8(16)6-10(9)22-13(12)14(20)21-7-11(19)18-5-1-4-17/h2-3,6H,1,5,7H2,(H,18,19)