2-[(E)-[1-(2-azanyl-1,3-thiazol-4-yl)-2-oxidanylidene-propylidene]amino]oxy-2-methyl-propanoic acid

Systemtic Name: 2-[(E)-[1-(2-azanyl-1,3-thiazol-4-yl)-2-oxidanylidene-propylidene]amino]oxy-2-methyl-propanoic acid Openeye Name: 2-[(E)-[1-(2-aminothiazol-4-yl)-2-oxo-propylidene]amino]oxy-2-methyl-propanoic acid CAS Name: 2-[(E)-[1-(2-amino-4-thiazolyl)-2-oxopropylidene]amino]oxy-2-methylpropanoic acid IUPAC Name: 2-[(E)-[1-(2-amino-1,3-thiazol-4-yl)-2-oxopropylidene]amino]oxy-2-methylpropanoic acid Traditional Name: 2-[(E)-[1-(2-aminothiazol-4-yl)-2-keto-propylidene]amino]oxy-2-methyl-propionic acid Formula: C10H13N3O4S MolecularWeight: 271.29292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NOC(C)(C)C(=O)O)C1=CSC(=N1)N

Isomeric SMILES

CC(=O)/C(=N/OC(C)(C)C(=O)O)/C1=CSC(=N1)N

InChI

InChI=1S/C10H13N3O4S/c1-5(14)7(6-4-18-9(11)12-6)13-17-10(2,3)8(15)16/h4H,1-3H3,(H2,11,12)(H,15,16)/b13-7-