sodium 2-methyl-2-(2-methylhexanethioylamino)propane-1-sulfonate

Systemtic Name: sodium 2-methyl-2-(2-methylhexanethioylamino)propane-1-sulfonate Openeye Name: sodium 2-methyl-2-(2-methylhexanethioylamino)propane-1-sulfonate CAS Name: sodium 2-methyl-2-[(2-methyl-1-sulfanylidenehexyl)amino]-1-propanesulfonate IUPAC Name: sodium 2-methyl-2-(2-methylhexanethioylamino)propane-1-sulfonate Traditional Name: sodium 2-methyl-2-(2-methylhexanethioylamino)propane-1-sulfonate Formula: C11H22NNaO3S2 MolecularWeight: 303.41705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(=S)NC(C)(C)CS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCC(C)C(=S)NC(C)(C)CS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H23NO3S2.Na/c1-5-6-7-9(2)10(16)12-11(3,4)8-17(13,14)15;/h9H,5-8H2,1-4H3,(H,12,16)(H,13,14,15);/q;+1/p-1