N-(2-morpholin-4-ylethyl)-4-pentyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-4-pentyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Openeye Name: N-(1-methyl-2-sulfanyl-ethyl)-N-(2-morpholinoethyl)-4-pentyl-benzenesulfonamide CAS Name: N-(1-mercaptopropan-2-yl)-N-[2-(4-morpholinyl)ethyl]-4-pentylbenzenesulfonamide IUPAC Name: N-(2-morpholin-4-ylethyl)-4-pentyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Traditional Name: 4-amyl-N-(2-mercapto-1-methyl-ethyl)-N-(2-morpholinoethyl)benzenesulfonamide Formula: C20H34N2O3S2 MolecularWeight: 414.62556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(CCN2CCOCC2)C(C)CS

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(CCN2CCOCC2)C(C)CS

InChI

InChI=1S/C20H34N2O3S2/c1-3-4-5-6-19-7-9-20(10-8-19)27(23,24)22(18(2)17-26)12-11-21-13-15-25-16-14-21/h7-10,18,26H,3-6,11-17H2,1-2H3