2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-methylsulfanyl-N-nonyl-butanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-methylsulfanyl-N-nonyl-butanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-methylsulfanyl-N-nonyl-butanamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-(methylthio)-N-nonylbutanamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-methylsulfanyl-N-nonylbutanamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-4-(methylthio)-N-nonyl-butyramide Formula: C22H36N2O5S2 MolecularWeight: 472.66164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCCCCCCCCNC(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C22H36N2O5S2/c1-3-4-5-6-7-8-9-13-23-22(25)19(12-16-30-2)24-31(26,27)18-10-11-20-21(17-18)29-15-14-28-20/h10-11,17,19,24H,3-9,12-16H2,1-2H3,(H,23,25)