ethyl 2-[2-(3-ethyl-6-methoxy-quinolin-2-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-(3-ethyl-6-methoxy-quinolin-2-yl)sulfanylethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[(3-ethyl-6-methoxy-2-quinolyl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[(3-ethyl-6-methoxy-2-quinolinyl)thio]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-ethyl-6-methoxyquinolin-2-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(3-ethyl-6-methoxy-2-quinolyl)thio]acetyl]amino]acetic acid ethyl ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NCC(=O)OCC

Isomeric SMILES

CCC1=C(N=C2C=CC(=CC2=C1)OC)SCC(=O)NCC(=O)OCC

InChI

InChI=1S/C18H22N2O4S/c1-4-12-8-13-9-14(23-3)6-7-15(13)20-18(12)25-11-16(21)19-10-17(22)24-5-2/h6-9H,4-5,10-11H2,1-3H3,(H,19,21)