5-[4-[[2-(3-methylsulfinyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]amino]butoxymethyl]pyridin-3-ol

Systemtic Name: 5-[4-[[2-(3-methylsulfinyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]amino]butoxymethyl]pyridin-3-ol Openeye Name: 5-[4-[[2-hydroxy-2-(4-hydroxy-3-methylsulfinyl-phenyl)ethyl]amino]butoxymethyl]pyridin-3-ol CAS Name: 5-[4-[[2-hydroxy-2-(4-hydroxy-3-methylsulfinylphenyl)ethyl]amino]butoxymethyl]-3-pyridinol IUPAC Name: 5-[4-[[2-hydroxy-2-(4-hydroxy-3-methylsulfinylphenyl)ethyl]amino]butoxymethyl]pyridin-3-ol Traditional Name: 5-[4-[[2-hydroxy-2-(4-hydroxy-3-methylsulfinyl-phenyl)ethyl]amino]butoxymethyl]pyridin-3-ol Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=C(C=CC(=C1)C(CNCCCCOCC2=CC(=CN=C2)O)O)O

Isomeric SMILES

CS(=O)C1=C(C=CC(=C1)C(CNCCCCOCC2=CC(=CN=C2)O)O)O

InChI

InChI=1S/C19H26N2O5S/c1-27(25)19-9-15(4-5-17(19)23)18(24)12-20-6-2-3-7-26-13-14-8-16(22)11-21-10-14/h4-5,8-11,18,20,22-24H,2-3,6-7,12-13H2,1H3