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

Systemtic Name: 4-[3-(2-azanyl-2-oxidanylidene-ethyl)sulfanylpropanoylamino]butanoic acid Openeye Name: 4-[3-(2-amino-2-oxo-ethyl)sulfanylpropanoylamino]butanoic acid CAS Name: 4-[[3-[(2-amino-2-oxoethyl)thio]-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[3-(2-amino-2-oxoethyl)sulfanylpropanoylamino]butanoic acid Traditional Name: 4-[3-[(2-amino-2-keto-ethyl)thio]propanoylamino]butyric acid Formula: C9H16N2O4S MolecularWeight: 248.29934

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)CNC(=O)CCSCC(=O)N

Isomeric SMILES

C(CC(=O)O)CNC(=O)CCSCC(=O)N

InChI

InChI=1S/C9H16N2O4S/c10-7(12)6-16-5-3-8(13)11-4-1-2-9(14)15/h1-6H2,(H2,10,12)(H,11,13)(H,14,15)