(6R,7R)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-[[1,5-bis(oxidanyl)-4-oxidanylidene-pyridin-2-yl]methoxyimino]ethanoyl]amino]-3-[(4-methyl-1,2,3-thiadiazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: (6R,7R)-7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-[[1,5-bis(oxidanyl)-4-oxidanylidene-pyridin-2-yl]methoxyimino]ethanoyl]amino]-3-[(4-methyl-1,2,3-thiadiazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: (6R,7R)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-[(1,5-dihydroxy-4-oxo-2-pyridyl)methoxyimino]acetyl]amino]-3-[(4-methylthiadiazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: (6R,7R)-7-[[(2E)-2-(2-amino-4-thiazolyl)-2-[(1,5-dihydroxy-4-oxo-2-pyridinyl)methoxyimino]-1-oxoethyl]amino]-3-[[(4-methyl-5-thiadiazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-[(1,5-dihydroxy-4-oxopyridin-2-yl)methoxyimino]acetyl]amino]-3-[(4-methylthiadiazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: (6R,7R)-7-[[(2E)-2-(2-aminothiazol-4-yl)-2-[(1,5-dihydroxy-4-keto-2-pyridyl)methyloximino]acetyl]amino]-8-keto-3-[[(4-methylthiadiazol-5-yl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C22H20N8O8S4 MolecularWeight: 652.703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(=NOCC4=CC(=O)C(=CN4O)O)C5=CSC(=N5)N)SC2)C(=O)O

Isomeric SMILES

CC1=C(SN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N/OCC4=CC(=O)C(=CN4O)O)/C5=CSC(=N5)N)SC2)C(=O)O

InChI

InChI=1S/C22H20N8O8S4/c1-8-21(42-28-26-8)40-6-9-5-39-19-15(18(34)30(19)16(9)20(35)36)25-17(33)14(11-7-41-22(23)24-11)27-38-4-10-2-12(31)13(32)3-29(10)37/h2-3,7,15,19,32,37H,4-6H2,1H3,(H2,23,24)(H,25,33)(H,35,36)/b27-14+/t15-,19-/m1/s1