(2S)-2-azaniumyl-5-[[(2S)-4-methylsulfanyl-1-oxidanidyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (2S)-2-azaniumyl-5-[[(2S)-4-methylsulfanyl-1-oxidanidyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: (2S)-2-azaniumyl-5-[[(1S)-1-carboxylato-3-methylsulfanyl-propyl]amino]-5-oxo-pentanoate CAS Name: (2S)-2-ammonio-5-[[(2S)-4-(methylthio)-1-oxido-1-oxobutan-2-yl]amino]-5-oxopentanoate IUPAC Name: (2S)-2-azaniumyl-5-[[(2S)-4-methylsulfanyl-1-oxido-1-oxobutan-2-yl]amino]-5-oxopentanoate Traditional Name: (2S)-2-ammonio-5-[[(1S)-1-carboxylato-3-(methylthio)propyl]amino]-5-keto-valerate Formula: C10H17N2O5S- MolecularWeight: 277.31738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)CCC(C(=O)[O-])[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)CC[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C10H18N2O5S/c1-18-5-4-7(10(16)17)12-8(13)3-2-6(11)9(14)15/h6-7H,2-5,11H2,1H3,(H,12,13)(H,14,15)(H,16,17)/p-1/t6-,7-/m0/s1