sodium 3-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-2-oxidanylidene-4-[1-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)ethyl]azetidine-1-sulfonate

Systemtic Name: sodium 3-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-2-oxidanylidene-4-[1-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)ethyl]azetidine-1-sulfonate Openeye Name: sodium 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methoxyimino-acetyl]amino]-2-oxo-4-[1-(2H-tetrazol-5-ylsulfanyl)ethyl]azetidine-1-sulfonate CAS Name: sodium 3-[[(2E)-2-[2-[(2-chloro-1-oxoethyl)amino]-4-thiazolyl]-2-methoxyimino-1-oxoethyl]amino]-2-oxo-4-[1-(2H-tetrazol-5-ylthio)ethyl]-1-azetidinesulfonate IUPAC Name: sodium 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]-1,3-thiazol-4-yl]-2-methoxyiminoacetyl]amino]-2-oxo-4-[1-(2H-tetrazol-5-ylsulfanyl)ethyl]azetidine-1-sulfonate Traditional Name: sodium 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methyloximino-acetyl]amino]-2-keto-4-[1-(2H-tetrazol-5-ylthio)ethyl]azetidine-1-sulfonate Formula: C14H15ClN9NaO7S3 MolecularWeight: 575.96277

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(C(=O)N1S(=O)(=O)[O-])NC(=O)C(=NOC)C2=CSC(=N2)NC(=O)CCl)SC3=NNN=N3.[Na+]

Isomeric SMILES

CC(C1C(C(=O)N1S(=O)(=O)[O-])NC(=O)/C(=N/OC)/C2=CSC(=N2)NC(=O)CCl)SC3=NNN=N3.[Na+]

InChI

InChI=1S/C14H16ClN9O7S3.Na/c1-5(33-14-19-22-23-20-14)10-9(12(27)24(10)34(28,29)30)18-11(26)8(21-31-2)6-4-32-13(16-6)17-7(25)3-15;/h4-5,9-10H,3H2,1-2H3,(H,18,26)(H,16,17,25)(H,28,29,30)(H,19,20,22,23);/q;+1/p-1/b21-8+;