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

Systemtic Name: 5-[2-[[3-(2-methyl-4-methylsulfanyl-phenoxy)-2-oxidanyl-propyl]amino]ethoxy]-2-oxidanyl-benzamide Openeye Name: 2-hydroxy-5-[2-[[2-hydroxy-3-(2-methyl-4-methylsulfanyl-phenoxy)propyl]amino]ethoxy]benzamide CAS Name: 2-hydroxy-5-[2-[[2-hydroxy-3-[2-methyl-4-(methylthio)phenoxy]propyl]amino]ethoxy]benzamide IUPAC Name: 2-hydroxy-5-[2-[[2-hydroxy-3-(2-methyl-4-methylsulfanylphenoxy)propyl]amino]ethoxy]benzamide Traditional Name: 2-hydroxy-5-[2-[[2-hydroxy-3-[2-methyl-4-(methylthio)phenoxy]propyl]amino]ethoxy]benzamide Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC)OCC(CNCCOC2=CC(=C(C=C2)O)C(=O)N)O

Isomeric SMILES

CC1=C(C=CC(=C1)SC)OCC(CNCCOC2=CC(=C(C=C2)O)C(=O)N)O

InChI

InChI=1S/C20H26N2O5S/c1-13-9-16(28-2)4-6-19(13)27-12-14(23)11-22-7-8-26-15-3-5-18(24)17(10-15)20(21)25/h3-6,9-10,14,22-24H,7-8,11-12H2,1-2H3,(H2,21,25)