4-but-2-ynoxy-N-methyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide

Systemtic Name: 4-but-2-ynoxy-N-methyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Openeye Name: 4-but-2-ynoxy-N-methyl-N-(1-methyl-2-sulfanyl-ethyl)benzenesulfonamide CAS Name: 4-but-2-ynoxy-N-(1-mercaptopropan-2-yl)-N-methylbenzenesulfonamide IUPAC Name: 4-but-2-ynoxy-N-methyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Traditional Name: 4-but-2-ynoxy-N-(2-mercapto-1-methyl-ethyl)-N-methyl-benzenesulfonamide Formula: C14H19NO3S2 MolecularWeight: 313.43556

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C(C)CS

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C(C)CS

InChI

InChI=1S/C14H19NO3S2/c1-4-5-10-18-13-6-8-14(9-7-13)20(16,17)15(3)12(2)11-19/h6-9,12,19H,10-11H2,1-3H3