N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]-2-(2-oxidanylidene-4-phenyl-chromen-7-yl)oxy-ethanamide

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]-2-(2-oxidanylidene-4-phenyl-chromen-7-yl)oxy-ethanamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-3-methylsulfanyl-propyl]-2-(2-oxo-4-phenyl-chromen-7-yl)oxy-acetamide CAS Name: N-[(2S)-1-hydroxy-4-(methylthio)butan-2-yl]-2-[(2-oxo-4-phenyl-1-benzopyran-7-yl)oxy]acetamide IUPAC Name: N-[(2S)-1-hydroxy-4-methylsulfanylbutan-2-yl]-2-(2-oxo-4-phenylchromen-7-yl)oxyacetamide Traditional Name: 2-(2-keto-4-phenyl-chromen-7-yl)oxy-N-[(1S)-1-methylol-3-(methylthio)propyl]acetamide Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(CO)NC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3

Isomeric SMILES

CSCC[C@@H](CO)NC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3

InChI

InChI=1S/C22H23NO5S/c1-29-10-9-16(13-24)23-21(25)14-27-17-7-8-18-19(15-5-3-2-4-6-15)12-22(26)28-20(18)11-17/h2-8,11-12,16,24H,9-10,13-14H2,1H3,(H,23,25)/t16-/m0/s1