3-[[2-azanyl-2-(5-chloranyl-1,3-thiazol-4-yl)ethanoyl]amino]-2-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[[2-azanyl-2-(5-chloranyl-1,3-thiazol-4-yl)ethanoyl]amino]-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[2-amino-2-(5-chlorothiazol-4-yl)acetyl]amino]-2-oxo-azetidine-1-sulfonic acid CAS Name: 3-[[2-amino-2-(5-chloro-4-thiazolyl)-1-oxoethyl]amino]-2-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[2-amino-2-(5-chloro-1,3-thiazol-4-yl)acetyl]amino]-2-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[2-amino-2-(5-chlorothiazol-4-yl)acetyl]amino]-2-keto-azetidine-1-sulfonic acid Formula: C8H9ClN4O5S2 MolecularWeight: 340.76386

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=C(SC=N2)Cl)N

Isomeric SMILES

C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=C(SC=N2)Cl)N

InChI

InChI=1S/C8H9ClN4O5S2/c9-6-5(11-2-19-6)4(10)7(14)12-3-1-13(8(3)15)20(16,17)18/h2-4H,1,10H2,(H,12,14)(H,16,17,18)