(2S)-2-[[(2S)-2-azaniumyl-4-methylsulfanyl-butanoyl]amino]butanedioate

Systemtic Name: (2S)-2-[[(2S)-2-azaniumyl-4-methylsulfanyl-butanoyl]amino]butanedioate Openeye Name: (2S)-2-[[(2S)-2-azaniumyl-4-methylsulfanyl-butanoyl]amino]butanedioate CAS Name: (2S)-2-[[(2S)-2-ammonio-4-(methylthio)-1-oxobutyl]amino]butanedioate IUPAC Name: (2S)-2-[[(2S)-2-azaniumyl-4-methylsulfanylbutanoyl]amino]butanedioate Traditional Name: (2S)-2-[[(2S)-2-ammonio-4-(methylthio)butanoyl]amino]succinate Formula: C9H15N2O5S- MolecularWeight: 263.2908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16N2O5S/c1-17-3-2-5(10)8(14)11-6(9(15)16)4-7(12)13/h5-6H,2-4,10H2,1H3,(H,11,14)(H,12,13)(H,15,16)/p-1/t5-,6-/m0/s1