ethyl 4-(3-chlorophenyl)-2-oxidanylidene-6-[oxidanyl-(4-phenyl-1,3-thiazol-2-yl)methyl]-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 4-(3-chlorophenyl)-2-oxidanylidene-6-[oxidanyl-(4-phenyl-1,3-thiazol-2-yl)methyl]-1H-quinoline-3-carboxylate Openeye Name: ethyl 4-(3-chlorophenyl)-6-[hydroxy-(4-phenylthiazol-2-yl)methyl]-2-oxo-1H-quinoline-3-carboxylate CAS Name: 4-(3-chlorophenyl)-6-[hydroxy-(4-phenyl-2-thiazolyl)methyl]-2-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-chlorophenyl)-6-[hydroxy-(4-phenyl-1,3-thiazol-2-yl)methyl]-2-oxo-1H-quinoline-3-carboxylate Traditional Name: 4-(3-chlorophenyl)-6-[hydroxy-(4-phenylthiazol-2-yl)methyl]-2-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C28H21ClN2O4S MolecularWeight: 516.99534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC(=C2)C(C3=NC(=CS3)C4=CC=CC=C4)O)NC1=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC(=C2)C(C3=NC(=CS3)C4=CC=CC=C4)O)NC1=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H21ClN2O4S/c1-2-35-28(34)24-23(17-9-6-10-19(29)13-17)20-14-18(11-12-21(20)30-26(24)33)25(32)27-31-22(15-36-27)16-7-4-3-5-8-16/h3-15,25,32H,2H2,1H3,(H,30,33)