[2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 2-methylquinoline-4-carboxylate

Systemtic Name: [2-[ethanoyl-(2-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 2-methylquinoline-4-carboxylate Openeye Name: [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-(N-acetyl-2-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-ethylanilino)-1,3-thiazol-4-yl]methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-(N-acetyl-2-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C2=NC(=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C)C(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(C2=NC(=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C)C(=O)C

InChI

InChI=1S/C25H23N3O3S/c1-4-18-9-5-8-12-23(18)28(17(3)29)25-27-19(15-32-25)14-31-24(30)21-13-16(2)26-22-11-7-6-10-20(21)22/h5-13,15H,4,14H2,1-3H3