[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(2,4-dimethylquinolin-3-yl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(2,4-dimethylquinolin-3-yl)ethanoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 2-(2,4-dimethyl-3-quinolyl)acetate CAS Name: 2-(2,4-dimethyl-3-quinolinyl)acetic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-(2,4-dimethylquinolin-3-yl)acetate Traditional Name: 2-(2,4-dimethyl-3-quinolyl)acetic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)OCC(=O)NCCC3=CC=CS3

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)OCC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C21H22N2O3S/c1-14-17-7-3-4-8-19(17)23-15(2)18(14)12-21(25)26-13-20(24)22-10-9-16-6-5-11-27-16/h3-8,11H,9-10,12-13H2,1-2H3,(H,22,24)