5-[2-[[3-[4-(2-methylsulfanylethoxy)phenoxy]-2-oxidanyl-propyl]amino]ethoxy]-2-oxidanyl-benzamide

Systemtic Name: 5-[2-[[3-[4-(2-methylsulfanylethoxy)phenoxy]-2-oxidanyl-propyl]amino]ethoxy]-2-oxidanyl-benzamide Openeye Name: 2-hydroxy-5-[2-[[2-hydroxy-3-[4-(2-methylsulfanylethoxy)phenoxy]propyl]amino]ethoxy]benzamide CAS Name: 2-hydroxy-5-[2-[[2-hydroxy-3-[4-[2-(methylthio)ethoxy]phenoxy]propyl]amino]ethoxy]benzamide IUPAC Name: 2-hydroxy-5-[2-[[2-hydroxy-3-[4-(2-methylsulfanylethoxy)phenoxy]propyl]amino]ethoxy]benzamide Traditional Name: 2-hydroxy-5-[2-[[2-hydroxy-3-[4-[2-(methylthio)ethoxy]phenoxy]propyl]amino]ethoxy]benzamide Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CSCCOC1=CC=C(C=C1)OCC(CNCCOC2=CC(=C(C=C2)O)C(=O)N)O

Isomeric SMILES

CSCCOC1=CC=C(C=C1)OCC(CNCCOC2=CC(=C(C=C2)O)C(=O)N)O

InChI

InChI=1S/C21H28N2O6S/c1-30-11-10-28-16-2-4-17(5-3-16)29-14-15(24)13-23-8-9-27-18-6-7-20(25)19(12-18)21(22)26/h2-7,12,15,23-25H,8-11,13-14H2,1H3,(H2,22,26)