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

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)carbonylamino]butanoic acid Openeye Name: 4-amino-4-oxo-2-[[5-(2-thienyl)isoxazole-3-carbonyl]amino]butanoic acid CAS Name: 4-amino-4-oxo-2-[[oxo-(5-thiophen-2-yl-3-isoxazolyl)methyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-[(5-thiophen-2-yl-1,2-oxazole-3-carbonyl)amino]butanoic acid Traditional Name: 4-amino-4-keto-2-[[5-(2-thienyl)isoxazole-3-carbonyl]amino]butyric acid Formula: C12H11N3O5S MolecularWeight: 309.29784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)C(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C12H11N3O5S/c13-10(16)5-7(12(18)19)14-11(17)6-4-8(20-15-6)9-2-1-3-21-9/h1-4,7H,5H2,(H2,13,16)(H,14,17)(H,18,19)