[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-(4-methylquinolin-2-yl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-(4-methylquinolin-2-yl)sulfanylethanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 2-[(4-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4-methyl-2-quinolinyl)thio]acetic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-(4-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-quinolyl)thio]acetic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC(=O)NCC3=CC=CS3

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C19H18N2O3S2/c1-13-9-18(21-16-7-3-2-6-15(13)16)26-12-19(23)24-11-17(22)20-10-14-5-4-8-25-14/h2-9H,10-12H2,1H3,(H,20,22)