(2-phenylazanyl-1,3-thiazol-4-yl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate Openeye Name: (2-anilinothiazol-4-yl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-4-quinolinecarboxylic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 2-(4-chlorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)cinchoninic acid (2-anilinothiazol-4-yl)methyl ester Formula: C26H18ClN3O2S MolecularWeight: 471.95802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H18ClN3O2S/c27-18-12-10-17(11-13-18)24-14-22(21-8-4-5-9-23(21)30-24)25(31)32-15-20-16-33-26(29-20)28-19-6-2-1-3-7-19/h1-14,16H,15H2,(H,28,29)