3-oxidanyl-2-[2-(thiophen-2-ylcarbonylamino)propanoylamino]butanoic acid

Systemtic Name: 3-oxidanyl-2-[2-(thiophen-2-ylcarbonylamino)propanoylamino]butanoic acid Openeye Name: 3-hydroxy-2-[2-(thiophene-2-carbonylamino)propanoylamino]butanoic acid CAS Name: 3-hydroxy-2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]propyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[2-(thiophene-2-carbonylamino)propanoylamino]butanoic acid Traditional Name: 3-hydroxy-2-[2-(2-thenoylamino)propanoylamino]butyric acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC=CS1)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C(C)NC(=O)C1=CC=CS1)O

InChI

InChI=1S/C12H16N2O5S/c1-6(13-11(17)8-4-3-5-20-8)10(16)14-9(7(2)15)12(18)19/h3-7,9,15H,1-2H3,(H,13,17)(H,14,16)(H,18,19)