3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-2-[3-(2-phenylsulfanylethyl)cyclohexyl]-5H-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-2-[3-(2-phenylsulfanylethyl)cyclohexyl]-5H-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-2-[3-(2-phenylsulfanylethyl)cyclohexyl]-5H-isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-2-[3-[2-(phenylthio)ethyl]cyclohexyl]-5H-isoxazole-4-carboxamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-2-[3-(2-phenylsulfanylethyl)cyclohexyl]-5H-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-2-[3-[2-(phenylthio)ethyl]cyclohexyl]-3-isoxazoline-4-carboxamide Formula: C25H28ClFN2O2S MolecularWeight: 475.018423

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(N(O1)C2CCCC(C2)CCSC3=CC=CC=C3)C4=C(C=CC=C4Cl)F)C(=O)N

Isomeric SMILES

CC1C(=C(N(O1)C2CCCC(C2)CCSC3=CC=CC=C3)C4=C(C=CC=C4Cl)F)C(=O)N

InChI

InChI=1S/C25H28ClFN2O2S/c1-16-22(25(28)30)24(23-20(26)11-6-12-21(23)27)29(31-16)18-8-5-7-17(15-18)13-14-32-19-9-3-2-4-10-19/h2-4,6,9-12,16-18H,5,7-8,13-15H2,1H3,(H2,28,30)