1,3-benzothiazol-2-ylmethyl 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylate CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H12ClFN2O3S MolecularWeight: 402.826583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H12ClFN2O3S/c1-10-16(18(23-26-10)17-11(20)5-4-6-12(17)21)19(24)25-9-15-22-13-7-2-3-8-14(13)27-15/h2-8H,9H2,1H3