3-sulfanyl-N-(3,4,5-trimethoxyphenyl)propane-1-sulfonamide

Systemtic Name: 3-sulfanyl-N-(3,4,5-trimethoxyphenyl)propane-1-sulfonamide Openeye Name: 3-sulfanyl-N-(3,4,5-trimethoxyphenyl)propane-1-sulfonamide CAS Name: 3-mercapto-N-(3,4,5-trimethoxyphenyl)-1-propanesulfonamide IUPAC Name: 3-sulfanyl-N-(3,4,5-trimethoxyphenyl)propane-1-sulfonamide Traditional Name: 3-mercapto-N-(3,4,5-trimethoxyphenyl)propane-1-sulfonamide Formula: C12H19NO5S2 MolecularWeight: 321.41296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NS(=O)(=O)CCCS

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NS(=O)(=O)CCCS

InChI

InChI=1S/C12H19NO5S2/c1-16-10-7-9(8-11(17-2)12(10)18-3)13-20(14,15)6-4-5-19/h7-8,13,19H,4-6H2,1-3H3