2-[(Z)-[1-(2-azanyl-1,3-thiazol-4-yl)-2-[[(2S,3S)-2-(oxidanylcarbamoylsulfanylmethyl)-4-oxidanylidene-1-sulfo-azetidin-3-yl]amino]-2-oxidanylidene-ethylidene]amino]oxyethanoic acid

Systemtic Name: 2-[(Z)-[1-(2-azanyl-1,3-thiazol-4-yl)-2-[[(2S,3S)-2-(oxidanylcarbamoylsulfanylmethyl)-4-oxidanylidene-1-sulfo-azetidin-3-yl]amino]-2-oxidanylidene-ethylidene]amino]oxyethanoic acid Openeye Name: 2-[(Z)-[1-(2-aminothiazol-4-yl)-2-[[(2S,3S)-2-(hydroxycarbamoylsulfanylmethyl)-4-oxo-1-sulfo-azetidin-3-yl]amino]-2-oxo-ethylidene]amino]oxyacetic acid CAS Name: 2-[(Z)-[1-(2-amino-4-thiazolyl)-2-[[(2S,3S)-2-[[[(hydroxyamino)-oxomethyl]thio]methyl]-4-oxo-1-sulfo-3-azetidinyl]amino]-2-oxoethylidene]amino]oxyacetic acid IUPAC Name: 2-[(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-[[(2S,3S)-2-(hydroxycarbamoylsulfanylmethyl)-4-oxo-1-sulfoazetidin-3-yl]amino]-2-oxoethylidene]amino]oxyacetic acid Traditional Name: 2-[(Z)-[1-(2-aminothiazol-4-yl)-2-[[(2S,3S)-2-[(hydroxycarbamoylthio)methyl]-4-keto-1-sulfo-azetidin-3-yl]amino]-2-keto-ethylidene]amino]oxyacetic acid Formula: C12H14N6O10S3 MolecularWeight: 498.46876

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)N)C(=NOCC(=O)O)C(=O)NC2C(N(C2=O)S(=O)(=O)O)CSC(=O)NO

Isomeric SMILES

C1=C(N=C(S1)N)/C(=N/OCC(=O)O)/C(=O)N[C@H]2[C@H](N(C2=O)S(=O)(=O)O)CSC(=O)NO

InChI

InChI=1S/C12H14N6O10S3/c13-11-14-4(2-29-11)7(17-28-1-6(19)20)9(21)15-8-5(3-30-12(23)16-24)18(10(8)22)31(25,26)27/h2,5,8,24H,1,3H2,(H2,13,14)(H,15,21)(H,16,23)(H,19,20)(H,25,26,27)/b17-7-/t5-,8+/m1/s1