N-methyl-N-(1-sulfanylpropan-2-yl)-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-methyl-N-(1-sulfanylpropan-2-yl)-1,3-benzodioxole-5-sulfonamide Openeye Name: N-methyl-N-(1-methyl-2-sulfanyl-ethyl)-1,3-benzodioxole-5-sulfonamide CAS Name: N-(1-mercaptopropan-2-yl)-N-methyl-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-methyl-N-(1-sulfanylpropan-2-yl)-1,3-benzodioxole-5-sulfonamide Traditional Name: N-(2-mercapto-1-methyl-ethyl)-N-methyl-1,3-benzodioxole-5-sulfonamide Formula: C11H15NO4S2 MolecularWeight: 289.3711

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)N(C)S(=O)(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(CS)N(C)S(=O)(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H15NO4S2/c1-8(6-17)12(2)18(13,14)9-3-4-10-11(5-9)16-7-15-10/h3-5,8,17H,6-7H2,1-2H3