[2-[(3,4-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl quinoline-5-carboxylate

Systemtic Name: [2-[(3,4-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl quinoline-5-carboxylate Openeye Name: [2-(N-acetyl-3,4-dimethyl-anilino)thiazol-4-yl]methyl quinoline-5-carboxylate CAS Name: 5-quinolinecarboxylic acid [2-(N-acetyl-3,4-dimethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-3,4-dimethylanilino)-1,3-thiazol-4-yl]methyl quinoline-5-carboxylate Traditional Name: quinoline-5-carboxylic acid [2-(N-acetyl-3,4-dimethyl-anilino)thiazol-4-yl]methyl ester Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=C4C=CC=NC4=CC=C3)C(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=C4C=CC=NC4=CC=C3)C(=O)C)C

InChI

InChI=1S/C24H21N3O3S/c1-15-9-10-19(12-16(15)2)27(17(3)28)24-26-18(14-31-24)13-30-23(29)21-6-4-8-22-20(21)7-5-11-25-22/h4-12,14H,13H2,1-3H3