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

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(2-ethylhexyl)-4-methylsulfanyl-butanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(2-ethylhexyl)-4-methylsulfanyl-butanamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(2-ethylhexyl)-4-(methylthio)butanamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(2-ethylhexyl)-4-methylsulfanylbutanamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(2-ethylhexyl)-4-(methylthio)butyramide Formula: C21H34N2O5S2 MolecularWeight: 458.63506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCCCC(CC)CNC(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C21H34N2O5S2/c1-4-6-7-16(5-2)15-22-21(24)18(10-13-29-3)23-30(25,26)17-8-9-19-20(14-17)28-12-11-27-19/h8-9,14,16,18,23H,4-7,10-13,15H2,1-3H3,(H,22,24)