3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-ethoxyimino-ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-ethoxyimino-ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-ethoxyimino-acetyl]amino]-2-methoxycarbonyl-4-oxo-azetidine-1-sulfonic acid CAS Name: 3-[[(2Z)-2-(2-amino-4-thiazolyl)-2-ethoxyimino-1-oxoethyl]amino]-2-methoxycarbonyl-4-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-ethoxyiminoacetyl]amino]-2-methoxycarbonyl-4-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-ethyloximino-acetyl]amino]-2-carbomethoxy-4-keto-azetidine-1-sulfonic acid Formula: C12H15N5O8S2 MolecularWeight: 421.4062

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C(C1=CSC(=N1)N)C(=O)NC2C(N(C2=O)S(=O)(=O)O)C(=O)OC

Isomeric SMILES

CCO/N=C(/C1=CSC(=N1)N)\C(=O)NC2C(N(C2=O)S(=O)(=O)O)C(=O)OC

InChI

InChI=1S/C12H15N5O8S2/c1-3-25-16-6(5-4-26-12(13)14-5)9(18)15-7-8(11(20)24-2)17(10(7)19)27(21,22)23/h4,7-8H,3H2,1-2H3,(H2,13,14)(H,15,18)(H,21,22,23)/b16-6-