2-[[2-(ethylsulfonylamino)-4-methylsulfanyl-butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-(ethylsulfonylamino)-4-methylsulfanyl-butanoyl]amino]ethanoic acid Openeye Name: 2-[[2-(ethylsulfonylamino)-4-methylsulfanyl-butanoyl]amino]acetic acid CAS Name: 2-[[2-(ethylsulfonylamino)-4-(methylthio)-1-oxobutyl]amino]acetic acid IUPAC Name: 2-[[2-(ethylsulfonylamino)-4-methylsulfanylbutanoyl]amino]acetic acid Traditional Name: 2-[[2-(esylamino)-4-(methylthio)butanoyl]amino]acetic acid Formula: C9H18N2O5S2 MolecularWeight: 298.37962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC(CCSC)C(=O)NCC(=O)O

Isomeric SMILES

CCS(=O)(=O)NC(CCSC)C(=O)NCC(=O)O

InChI

InChI=1S/C9H18N2O5S2/c1-3-18(15,16)11-7(4-5-17-2)9(14)10-6-8(12)13/h7,11H,3-6H2,1-2H3,(H,10,14)(H,12,13)