4-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanylethanoylamino]butanoic acid

Systemtic Name: 4-[2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanylethanoylamino]butanoic acid Openeye Name: 4-[[2-(2-morpholino-2-oxo-ethyl)sulfanylacetyl]amino]butanoic acid CAS Name: 4-[[2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetyl]amino]butanoic acid Traditional Name: 4-[[2-[(2-keto-2-morpholino-ethyl)thio]acetyl]amino]butyric acid Formula: C12H20N2O5S MolecularWeight: 304.3626

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSCC(=O)NCCCC(=O)O

Isomeric SMILES

C1COCCN1C(=O)CSCC(=O)NCCCC(=O)O

InChI

InChI=1S/C12H20N2O5S/c15-10(13-3-1-2-12(17)18)8-20-9-11(16)14-4-6-19-7-5-14/h1-9H2,(H,13,15)(H,17,18)