[2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl quinoline-2-carboxylate

Systemtic Name: [2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl quinoline-2-carboxylate Openeye Name: [2-[2-(2-methylanilino)-2-oxo-ethyl]thiazol-4-yl]methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-[2-(2-methylanilino)-2-oxoethyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl quinoline-2-carboxylate Traditional Name: quinaldic acid [2-[2-keto-2-(o-toluidino)ethyl]thiazol-4-yl]methyl ester Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)COC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)COC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H19N3O3S/c1-15-6-2-4-8-18(15)26-21(27)12-22-24-17(14-30-22)13-29-23(28)20-11-10-16-7-3-5-9-19(16)25-20/h2-11,14H,12-13H2,1H3,(H,26,27)