3-[2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanylethanoylamino]benzoic acid

Systemtic Name: 3-[2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanylethanoylamino]benzoic acid Openeye Name: 3-[[2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]acetyl]amino]benzoic acid CAS Name: 3-[[2-[(8-methoxy-4-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-(8-methoxy-4-methylquinolin-2-yl)sulfanylacetyl]amino]benzoic acid Traditional Name: 3-[[2-[(8-methoxy-4-methyl-2-quinolyl)thio]acetyl]amino]benzoic acid Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)SCC(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)SCC(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H18N2O4S/c1-12-9-18(22-19-15(12)7-4-8-16(19)26-2)27-11-17(23)21-14-6-3-5-13(10-14)20(24)25/h3-10H,11H2,1-2H3,(H,21,23)(H,24,25)