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

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(6-methylheptan-2-yl)-4-methylsulfanyl-butanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(1,5-dimethylhexyl)-4-methylsulfanyl-butanamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(6-methylheptan-2-yl)-4-(methylthio)butanamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(6-methylheptan-2-yl)-4-methylsulfanylbutanamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(1,5-dimethylhexyl)-4-(methylthio)butyramide Formula: C21H34N2O5S2 MolecularWeight: 458.63506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CC(C)CCCC(C)NC(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

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