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

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-[2-(2-thienylmethylsulfanyl)ethyl]isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[2-(thiophen-2-ylmethylthio)ethyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-N-[2-(2-thenylthio)ethyl]isoxazole-4-carboxamide Formula: C18H16ClFN2O2S2 MolecularWeight: 410.913243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NCCSCC3=CC=CS3

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C18H16ClFN2O2S2/c1-11-15(17(22-24-11)16-13(19)5-2-6-14(16)20)18(23)21-7-9-25-10-12-4-3-8-26-12/h2-6,8H,7,9-10H2,1H3,(H,21,23)