3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(3-pyridinylmethylthio)phenyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-[4-(3-pyridylmethylthio)phenyl]isoxazole-4-carboxamide Formula: C23H17ClFN3O2S MolecularWeight: 453.916383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C23H17ClFN3O2S/c1-14-20(22(28-30-14)21-18(24)5-2-6-19(21)25)23(29)27-16-7-9-17(10-8-16)31-13-15-4-3-11-26-12-15/h2-12H,13H2,1H3,(H,27,29)