[2-[2-[2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethylamino]-2-oxidanylidene-ethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-[2-[2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethylamino]-2-oxidanylidene-ethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate Openeye Name: [2-[2-(2,4-dioxothiazolidin-3-yl)ethylamino]-2-oxo-ethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate CAS Name: 2-(2,4-dimethylphenyl)-4-quinolinecarboxylic acid [2-[2-(2,4-dioxo-3-thiazolidinyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethylamino]-2-oxoethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 2-(2,4-dimethylphenyl)cinchoninic acid [2-[2-(2,4-diketothiazolidin-3-yl)ethylamino]-2-keto-ethyl] ester Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCCN4C(=O)CSC4=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NCCN4C(=O)CSC4=O)C

InChI

InChI=1S/C25H23N3O5S/c1-15-7-8-17(16(2)11-15)21-12-19(18-5-3-4-6-20(18)27-21)24(31)33-13-22(29)26-9-10-28-23(30)14-34-25(28)32/h3-8,11-12H,9-10,13-14H2,1-2H3,(H,26,29)