sodium 7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-3-[(5-oxidanylidene-2H-furan-3-yl)sulfanyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: sodium 7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-3-[(5-oxidanylidene-2H-furan-3-yl)sulfanyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: sodium 7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-3-[(5-oxo-2H-furan-3-yl)sulfanyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: sodium 7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-3-[(5-oxo-2H-furan-3-yl)thio]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: sodium 7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-[(5-oxo-2H-furan-3-yl)sulfanyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: sodium 7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-8-keto-3-[(5-keto-2H-furan-3-yl)thio]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C17H14N5NaO7S3 MolecularWeight: 519.50713

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)SC4=CC(=O)OC4)C(=O)[O-].[Na+]

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)N)/C(=O)NC2C3N(C2=O)C(=C(CS3)SC4=CC(=O)OC4)C(=O)[O-].[Na+]

InChI

InChI=1S/C17H15N5O7S3.Na/c1-28-21-10(7-4-31-17(18)19-7)13(24)20-11-14(25)22-12(16(26)27)8(5-30-15(11)22)32-6-2-9(23)29-3-6;/h2,4,11,15H,3,5H2,1H3,(H2,18,19)(H,20,24)(H,26,27);/q;+1/p-1/b21-10+;