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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)COC(=O)C3=NC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)COC(=O)C3=NC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C23H19N3O3S/c1-14-7-8-17(11-15(14)2)20-13-30-23(25-20)26-21(27)12-29-22(28)19-10-9-16-5-3-4-6-18(16)24-19/h3-11,13H,12H2,1-2H3,(H,25,26,27)