N-[(5-fluoranyl-2-methyl-phenyl)methyl]-5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(5-fluoranyl-2-methyl-phenyl)methyl]-5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[(5-fluoro-2-methyl-phenyl)methyl]-5-[(2-methylsulfanylphenoxy)methyl]isoxazole-3-carboxamide CAS Name: N-[(5-fluoro-2-methylphenyl)methyl]-5-[[2-(methylthio)phenoxy]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[(5-fluoro-2-methylphenyl)methyl]-5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(5-fluoro-2-methyl-benzyl)-5-[[2-(methylthio)phenoxy]methyl]isoxazole-3-carboxamide Formula: C20H19FN2O3S MolecularWeight: 386.439863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)CNC(=O)C2=NOC(=C2)COC3=CC=CC=C3SC

Isomeric SMILES

CC1=C(C=C(C=C1)F)CNC(=O)C2=NOC(=C2)COC3=CC=CC=C3SC

InChI

InChI=1S/C20H19FN2O3S/c1-13-7-8-15(21)9-14(13)11-22-20(24)17-10-16(26-23-17)12-25-18-5-3-4-6-19(18)27-2/h3-10H,11-12H2,1-2H3,(H,22,24)