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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C)C(=O)C

InChI

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