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

Systemtic Name: N,N-dimethyl-6-[2-oxidanyl-3-(4-propanoylphenoxy)propyl]sulfanyl-pyridine-3-sulfonamide Openeye Name: 6-[2-hydroxy-3-(4-propanoylphenoxy)propyl]sulfanyl-N,N-dimethyl-pyridine-3-sulfonamide CAS Name: 6-[[2-hydroxy-3-[4-(1-oxopropyl)phenoxy]propyl]thio]-N,N-dimethyl-3-pyridinesulfonamide IUPAC Name: 6-[2-hydroxy-3-(4-propanoylphenoxy)propyl]sulfanyl-N,N-dimethylpyridine-3-sulfonamide Traditional Name: 6-[[2-hydroxy-3-(4-propionylphenoxy)propyl]thio]-N,N-dimethyl-pyridine-3-sulfonamide Formula: C19H24N2O5S2 MolecularWeight: 424.53426

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CSC2=NC=C(C=C2)S(=O)(=O)N(C)C)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CSC2=NC=C(C=C2)S(=O)(=O)N(C)C)O

InChI

InChI=1S/C19H24N2O5S2/c1-4-18(23)14-5-7-16(8-6-14)26-12-15(22)13-27-19-10-9-17(11-20-19)28(24,25)21(2)3/h5-11,15,22H,4,12-13H2,1-3H3