2-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[3-(2-amino-2-oxo-ethyl)sulfanylpropanoylamino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[3-[(2-amino-2-oxoethyl)thio]-1-oxopropyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[3-(2-amino-2-oxoethyl)sulfanylpropanoylamino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[3-[(2-amino-2-keto-ethyl)thio]propanoylamino]-4-mesyl-butyric acid Formula: C10H18N2O6S2 MolecularWeight: 326.38972

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)CCSCC(=O)N

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)CCSCC(=O)N

InChI

InChI=1S/C10H18N2O6S2/c1-20(17,18)5-3-7(10(15)16)12-9(14)2-4-19-6-8(11)13/h7H,2-6H2,1H3,(H2,11,13)(H,12,14)(H,15,16)