3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-oxidanylidene-4-[[2,2,2-tris(fluoranyl)ethanoylamino]methyl]azetidine-1-sulfonic acid

Systemtic Name: 3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-oxidanylidene-4-[[2,2,2-tris(fluoranyl)ethanoylamino]methyl]azetidine-1-sulfonic acid Openeye Name: 3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-oxo-4-[[(2,2,2-trifluoroacetyl)amino]methyl]azetidine-1-sulfonic acid CAS Name: 3-[[(2Z)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-2-oxo-4-[[(2,2,2-trifluoro-1-oxoethyl)amino]methyl]-1-azetidinesulfonic acid IUPAC Name: 3-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-2-oxo-4-[[(2,2,2-trifluoroacetyl)amino]methyl]azetidine-1-sulfonic acid Traditional Name: 3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-2-keto-4-[[(2,2,2-trifluoroacetyl)amino]methyl]azetidine-1-sulfonic acid Formula: C12H13F3N6O7S2 MolecularWeight: 474.39283

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)N)C(=O)NC2C(N(C2=O)S(=O)(=O)O)CNC(=O)C(F)(F)F

Isomeric SMILES

CO/N=C(/C1=CSC(=N1)N)\C(=O)NC2C(N(C2=O)S(=O)(=O)O)CNC(=O)C(F)(F)F

InChI

InChI=1S/C12H13F3N6O7S2/c1-28-20-6(4-3-29-11(16)18-4)8(22)19-7-5(2-17-10(24)12(13,14)15)21(9(7)23)30(25,26)27/h3,5,7H,2H2,1H3,(H2,16,18)(H,17,24)(H,19,22)(H,25,26,27)/b20-6-