[2-[bis(2-hydroxyethyl)amino]-2-oxidanylidene-ethyl] 2-azanyl-4,4-bis(methylsulfanyl)butanoate

Systemtic Name: [2-[bis(2-hydroxyethyl)amino]-2-oxidanylidene-ethyl] 2-azanyl-4,4-bis(methylsulfanyl)butanoate Openeye Name: [2-[bis(2-hydroxyethyl)amino]-2-oxo-ethyl] 2-amino-4,4-bis(methylsulfanyl)butanoate CAS Name: 2-amino-4,4-bis(methylthio)butanoic acid [2-[bis(2-hydroxyethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-hydroxyethyl)amino]-2-oxoethyl] 2-amino-4,4-bis(methylsulfanyl)butanoate Traditional Name: 2-amino-4,4-bis(methylthio)butyric acid [2-[bis(2-hydroxyethyl)amino]-2-keto-ethyl] ester Formula: C12H24N2O5S2 MolecularWeight: 340.45936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(C(=O)OCC(=O)N(CCO)CCO)N)SC

Isomeric SMILES

CSC(CC(C(=O)OCC(=O)N(CCO)CCO)N)SC

InChI

InChI=1S/C12H24N2O5S2/c1-20-11(21-2)7-9(13)12(18)19-8-10(17)14(3-5-15)4-6-16/h9,11,15-16H,3-8,13H2,1-2H3