ethyl 2-[2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[(6-ethoxy-3-methyl-2-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 2-[[2-[(6-ethoxy-3-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-ethoxy-3-methylquinolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(6-ethoxy-3-methyl-2-quinolyl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)NC3=CC=CC=C3C(=O)OCC)C

Isomeric SMILES

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)NC3=CC=CC=C3C(=O)OCC)C

InChI

InChI=1S/C23H24N2O4S/c1-4-28-17-10-11-19-16(13-17)12-15(3)22(25-19)30-14-21(26)24-20-9-7-6-8-18(20)23(27)29-5-2/h6-13H,4-5,14H2,1-3H3,(H,24,26)