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

Systemtic Name: 3-[[2-(aminocarbonylamino)-2-(2-azanyl-1,3-thiazol-4-yl)ethanoyl]amino]-2-methoxycarbonyl-4-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[2-(2-aminothiazol-4-yl)-2-ureido-acetyl]amino]-2-methoxycarbonyl-4-oxo-azetidine-1-sulfonic acid CAS Name: 3-[[2-(2-amino-4-thiazolyl)-2-(carbamoylamino)-1-oxoethyl]amino]-2-methoxycarbonyl-4-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[2-(2-amino-1,3-thiazol-4-yl)-2-(carbamoylamino)acetyl]amino]-2-methoxycarbonyl-4-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[2-(2-aminothiazol-4-yl)-2-ureido-acetyl]amino]-2-carbomethoxy-4-keto-azetidine-1-sulfonic acid Formula: C11H14N6O8S2 MolecularWeight: 422.39426

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CSC(=N2)N)NC(=O)N

Isomeric SMILES

COC(=O)C1C(C(=O)N1S(=O)(=O)O)NC(=O)C(C2=CSC(=N2)N)NC(=O)N

InChI

InChI=1S/C11H14N6O8S2/c1-25-9(20)6-5(8(19)17(6)27(22,23)24)15-7(18)4(16-10(12)21)3-2-26-11(13)14-3/h2,4-6H,1H3,(H2,13,14)(H,15,18)(H3,12,16,21)(H,22,23,24)