4-methylsulfanyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)carbonylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[[5-(2-thienyl)isoxazole-3-carbonyl]amino]butanoic acid CAS Name: 4-(methylthio)-2-[[oxo-(5-thiophen-2-yl-3-isoxazolyl)methyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[(5-thiophen-2-yl-1,2-oxazole-3-carbonyl)amino]butanoic acid Traditional Name: 4-(methylthio)-2-[[5-(2-thienyl)isoxazole-3-carbonyl]amino]butyric acid Formula: C13H14N2O4S2 MolecularWeight: 326.39126

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=NOC(=C1)C2=CC=CS2

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=NOC(=C1)C2=CC=CS2

InChI

InChI=1S/C13H14N2O4S2/c1-20-6-4-8(13(17)18)14-12(16)9-7-10(19-15-9)11-3-2-5-21-11/h2-3,5,7-8H,4,6H2,1H3,(H,14,16)(H,17,18)