methyl 3-[2-(3-ethyl-6,7-dimethoxy-quinolin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 3-[2-(3-ethyl-6,7-dimethoxy-quinolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: methyl 3-[[2-[(3-ethyl-6,7-dimethoxy-2-quinolyl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-[[2-[(3-ethyl-6,7-dimethoxy-2-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-ethyl-6,7-dimethoxyquinolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[(3-ethyl-6,7-dimethoxy-2-quinolyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CCC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C23H24N2O5S/c1-5-14-9-16-11-19(28-2)20(29-3)12-18(16)25-22(14)31-13-21(26)24-17-8-6-7-15(10-17)23(27)30-4/h6-12H,5,13H2,1-4H3,(H,24,26)