(5-chloranylquinolin-8-yl) 2-[(4-fluoranylphenoxy)methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: (5-chloranylquinolin-8-yl) 2-[(4-fluoranylphenoxy)methyl]-1,3-thiazole-4-carboxylate Openeye Name: (5-chloro-8-quinolyl) 2-[(4-fluorophenoxy)methyl]thiazole-4-carboxylate CAS Name: 2-[(4-fluorophenoxy)methyl]-4-thiazolecarboxylic acid (5-chloro-8-quinolinyl) ester IUPAC Name: (5-chloroquinolin-8-yl) 2-[(4-fluorophenoxy)methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(4-fluorophenoxy)methyl]thiazole-4-carboxylic acid (5-chloro-8-quinolyl) ester Formula: C20H12ClFN2O3S MolecularWeight: 414.837283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=CSC(=N3)COC4=CC=C(C=C4)F)Cl

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)OC(=O)C3=CSC(=N3)COC4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C20H12ClFN2O3S/c21-15-7-8-17(19-14(15)2-1-9-23-19)27-20(25)16-11-28-18(24-16)10-26-13-5-3-12(22)4-6-13/h1-9,11H,10H2