5-[(3-ethanoylphenoxy)methyl]-N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(3-ethanoylphenoxy)methyl]-N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[(3-acetylphenoxy)methyl]-N-[(1S)-1-(hydroxymethyl)-3-methylsulfanyl-propyl]isoxazole-3-carboxamide CAS Name: 5-[(3-acetylphenoxy)methyl]-N-[(2S)-1-hydroxy-4-(methylthio)butan-2-yl]-3-isoxazolecarboxamide IUPAC Name: 5-[(3-acetylphenoxy)methyl]-N-[(2S)-1-hydroxy-4-methylsulfanylbutan-2-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[(3-acetylphenoxy)methyl]-N-[(1S)-1-methylol-3-(methylthio)propyl]isoxazole-3-carboxamide Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC2=CC(=NO2)C(=O)NC(CCSC)CO

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC2=CC(=NO2)C(=O)N[C@@H](CCSC)CO

InChI

InChI=1S/C18H22N2O5S/c1-12(22)13-4-3-5-15(8-13)24-11-16-9-17(20-25-16)18(23)19-14(10-21)6-7-26-2/h3-5,8-9,14,21H,6-7,10-11H2,1-2H3,(H,19,23)/t14-/m0/s1