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

Systemtic Name: 3-[[(2Z)-2-methoxyimino-2-[2-(propanethioylamino)-1,3-thiazol-4-yl]ethanoyl]amino]-2-methylsulfanyl-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: 3-[[(2Z)-2-methoxyimino-2-[2-(propanethioylamino)thiazol-4-yl]acetyl]amino]-2-methylsulfanyl-4-oxo-azetidine-1-sulfonate CAS Name: 3-[[(2Z)-2-methoxyimino-1-oxo-2-[2-(1-sulfanylidenepropylamino)-4-thiazolyl]ethyl]amino]-2-(methylthio)-4-oxo-1-azetidinesulfonate IUPAC Name: 3-[[(2Z)-2-methoxyimino-2-[2-(propanethioylamino)-1,3-thiazol-4-yl]acetyl]amino]-2-methylsulfanyl-4-oxoazetidine-1-sulfonate Traditional Name: 2-keto-3-[[(2Z)-2-methyloximino-2-[2-(propanethioylamino)thiazol-4-yl]acetyl]amino]-4-(methylthio)azetidine-1-sulfonate Formula: C13H16N5O6S4- MolecularWeight: 466.55604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)NC1=NC(=CS1)C(=NOC)C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])SC

Isomeric SMILES

CCC(=S)NC1=NC(=CS1)/C(=N/OC)/C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])SC

InChI

InChI=1S/C13H17N5O6S4/c1-4-7(25)15-13-14-6(5-27-13)8(17-24-2)10(19)16-9-11(20)18(12(9)26-3)28(21,22)23/h5,9,12H,4H2,1-3H3,(H,16,19)(H,14,15,25)(H,21,22,23)/p-1/b17-8-