tert-butyl 2-[(E)-[1-(2-azanyl-1,3-thiazol-4-yl)-2-ethylsulfanyl-2-oxidanylidene-ethylidene]amino]oxyethanoate

Systemtic Name: tert-butyl 2-[(E)-[1-(2-azanyl-1,3-thiazol-4-yl)-2-ethylsulfanyl-2-oxidanylidene-ethylidene]amino]oxyethanoate Openeye Name: tert-butyl 2-[(E)-[1-(2-aminothiazol-4-yl)-2-ethylsulfanyl-2-oxo-ethylidene]amino]oxyacetate CAS Name: 2-[(E)-[1-(2-amino-4-thiazolyl)-2-(ethylthio)-2-oxoethylidene]amino]oxyacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(E)-[1-(2-amino-1,3-thiazol-4-yl)-2-ethylsulfanyl-2-oxoethylidene]amino]oxyacetate Traditional Name: 2-[(E)-[1-(2-aminothiazol-4-yl)-2-(ethylthio)-2-keto-ethylidene]amino]oxyacetic acid tert-butyl ester Formula: C13H19N3O4S2 MolecularWeight: 345.43766

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C(=NOCC(=O)OC(C)(C)C)C1=CSC(=N1)N

Isomeric SMILES

CCSC(=O)/C(=N/OCC(=O)OC(C)(C)C)/C1=CSC(=N1)N

InChI

InChI=1S/C13H19N3O4S2/c1-5-21-11(18)10(8-7-22-12(14)15-8)16-19-6-9(17)20-13(2,3)4/h7H,5-6H2,1-4H3,(H2,14,15)/b16-10+