[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl quinoline-2-carboxylate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl quinoline-2-carboxylate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl quinoline-2-carboxylate Traditional Name: quinaldic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=NC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=NC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C22H18N2O4S/c1-26-19-10-8-15(11-20(19)27-2)21-23-16(13-29-21)12-28-22(25)18-9-7-14-5-3-4-6-17(14)24-18/h3-11,13H,12H2,1-2H3