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

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H10Cl2N2O3S MolecularWeight: 357.2118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)SC(=C2Cl)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)SC(=C2Cl)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H10Cl2N2O3S/c15-8-2-3-9-10(6-8)22-13(12(9)16)14(20)21-7-11(19)18-5-1-4-17/h2-3,6H,1,5,7H2,(H,18,19)