[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] quinoline-8-carboxylate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] quinoline-8-carboxylate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] quinoline-8-carboxylate CAS Name: 8-quinolinecarboxylic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] quinoline-8-carboxylate Traditional Name: quinoline-8-carboxylic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)OCC(=O)NCCSCC3=CC=CS3)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)OCC(=O)NCCSCC3=CC=CS3)N=CC=C2

InChI

InChI=1S/C19H18N2O3S2/c22-17(20-9-11-25-13-15-6-3-10-26-15)12-24-19(23)16-7-1-4-14-5-2-8-21-18(14)16/h1-8,10H,9,11-13H2,(H,20,22)