sodium 3-[2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-2-oxidanylidene-azetidine-1-sulfonate

Systemtic Name: sodium 3-[2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-2-oxidanylidene-azetidine-1-sulfonate Openeye Name: sodium 3-[[2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]acetyl]amino]-2-oxo-azetidine-1-sulfonate CAS Name: sodium 3-[[2-[2-[(2-chloro-1-oxoethyl)amino]-4-thiazolyl]-1-oxoethyl]amino]-2-oxo-1-azetidinesulfonate IUPAC Name: sodium 3-[[2-[2-[(2-chloroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-2-oxoazetidine-1-sulfonate Traditional Name: sodium 3-[[2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]acetyl]amino]-2-keto-azetidine-1-sulfonate Formula: C10H10ClN4NaO6S2 MolecularWeight: 404.78237

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1S(=O)(=O)[O-])NC(=O)CC2=CSC(=N2)NC(=O)CCl.[Na+]

Isomeric SMILES

C1C(C(=O)N1S(=O)(=O)[O-])NC(=O)CC2=CSC(=N2)NC(=O)CCl.[Na+]

InChI

InChI=1S/C10H11ClN4O6S2.Na/c11-2-8(17)14-10-12-5(4-22-10)1-7(16)13-6-3-15(9(6)18)23(19,20)21;/h4,6H,1-3H2,(H,13,16)(H,12,14,17)(H,19,20,21);/q;+1/p-1