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2-[4-[(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanylmethyl]phenyl]ethanoic acid
2-[4-[(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanylmethyl]phenyl]ethanoic acid
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Canonical SMILES:
COC1=C(C=C2C(=C1)C=C(C(=N2)SCC3=CC=C(C=C3)CC(=O)O)C#N)OC
Isomeric SMILES
COC1=C(C=C2C(=C1)C=C(C(=N2)SCC3=CC=C(C=C3)CC(=O)O)C#N)OC
InChI
InChI=1S/C21H18N2O4S/c1-26-18-9-15-8-16(11-22)21(23-17(15)10-19(18)27-2)28-12-14-5-3-13(4-6-14)7-20(24)25/h3-6,8-10H,7,12H2,1-2H3,(H,24,25)
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