6-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide Openeye Name: 6-[3-(4-chlorophenoxy)-2-hydroxy-propyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide CAS Name: 6-[[3-(4-chlorophenoxy)-2-hydroxypropyl]thio]-N,N-diethyl-3-pyridinesulfonamide IUPAC Name: 6-[3-(4-chlorophenoxy)-2-hydroxypropyl]sulfanyl-N,N-diethylpyridine-3-sulfonamide Traditional Name: 6-[[3-(4-chlorophenoxy)-2-hydroxy-propyl]thio]-N,N-diethyl-pyridine-3-sulfonamide Formula: C18H23ClN2O4S2 MolecularWeight: 430.96922

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(COC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(COC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C18H23ClN2O4S2/c1-3-21(4-2)27(23,24)17-9-10-18(20-11-17)26-13-15(22)12-25-16-7-5-14(19)6-8-16/h5-11,15,22H,3-4,12-13H2,1-2H3