2-(2-azanylethylsulfanyl)-3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-4-oxidanylidene-azetidine-1-sulfonate

Systemtic Name: 2-(2-azanylethylsulfanyl)-3-[[(2Z)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: 2-(2-aminoethylsulfanyl)-3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-4-oxo-azetidine-1-sulfonate CAS Name: 2-(2-aminoethylthio)-3-[[(2Z)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-4-oxo-1-azetidinesulfonate IUPAC Name: 2-(2-aminoethylsulfanyl)-3-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-4-oxoazetidine-1-sulfonate Traditional Name: 2-(2-aminoethylthio)-3-[[(2Z)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-4-keto-azetidine-1-sulfonate Formula: C11H15N6O6S3- MolecularWeight: 423.4684

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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-])SCCN

Isomeric SMILES

CO/N=C(/C1=CSC(=N1)N)\C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])SCCN

InChI

InChI=1S/C11H16N6O6S3/c1-23-16-6(5-4-25-11(13)14-5)8(18)15-7-9(19)17(26(20,21)22)10(7)24-3-2-12/h4,7,10H,2-3,12H2,1H3,(H2,13,14)(H,15,18)(H,20,21,22)/p-1/b16-6-