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

Systemtic Name: [2-[(4-naphthalen-1-yl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [2-[[4-(1-naphthyl)thiazol-2-yl]amino]-2-oxo-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [2-[[4-(1-naphthalenyl)-2-thiazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-naphthalen-1-yl-1,3-thiazol-2-yl)amino]-2-oxoethyl] 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid [2-keto-2-[[4-(1-naphthyl)thiazol-2-yl]amino]ethyl] ester Formula: C28H23N3O3S MolecularWeight: 481.56552

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)NC3=NC(=CS3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)NC3=NC(=CS3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H23N3O3S/c1-3-22-17(2)26(21-12-6-7-14-23(21)29-22)27(33)34-15-25(32)31-28-30-24(16-35-28)20-13-8-10-18-9-4-5-11-19(18)20/h4-14,16H,3,15H2,1-2H3,(H,30,31,32)