3-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-cyclohexylsulfanyl-4-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-cyclohexylsulfanyl-4-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 3-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-cyclohexylsulfanyl-4-oxo-azetidine-1-sulfonic acid CAS Name: 3-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-2-(cyclohexylthio)-4-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-2-cyclohexylsulfanyl-4-oxoazetidine-1-sulfonic acid Traditional Name: 3-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-2-(cyclohexylthio)-4-keto-azetidine-1-sulfonic acid Formula: C15H21N5O6S3 MolecularWeight: 463.55214

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)N)C(=O)NC2C(N(C2=O)S(=O)(=O)O)SC3CCCCC3

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)N)/C(=O)NC2C(N(C2=O)S(=O)(=O)O)SC3CCCCC3

InChI

InChI=1S/C15H21N5O6S3/c1-26-19-10(9-7-27-15(16)17-9)12(21)18-11-13(22)20(29(23,24)25)14(11)28-8-5-3-2-4-6-8/h7-8,11,14H,2-6H2,1H3,(H2,16,17)(H,18,21)(H,23,24,25)/b19-10+