3-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-3-methoxy-2-methylsulfanyl-4-oxidanylidene-azetidine-1-sulfonate

Systemtic Name: 3-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-3-methoxy-2-methylsulfanyl-4-oxidanylidene-azetidine-1-sulfonate Openeye Name: 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methoxyimino-acetyl]amino]-3-methoxy-2-methylsulfanyl-4-oxo-azetidine-1-sulfonate CAS Name: 3-[[(2E)-2-[2-[(2-chloro-1-oxoethyl)amino]-4-thiazolyl]-2-methoxyimino-1-oxoethyl]amino]-3-methoxy-2-(methylthio)-4-oxo-1-azetidinesulfonate IUPAC Name: 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]-1,3-thiazol-4-yl]-2-methoxyiminoacetyl]amino]-3-methoxy-2-methylsulfanyl-4-oxoazetidine-1-sulfonate Traditional Name: 3-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methyloximino-acetyl]amino]-2-keto-3-methoxy-4-(methylthio)azetidine-1-sulfonate Formula: C13H15ClN5O8S3- MolecularWeight: 500.9349

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C(N(C1=O)S(=O)(=O)[O-])SC)NC(=O)C(=NOC)C2=CSC(=N2)NC(=O)CCl

Isomeric SMILES

COC1(C(N(C1=O)S(=O)(=O)[O-])SC)NC(=O)/C(=N/OC)/C2=CSC(=N2)NC(=O)CCl

InChI

InChI=1S/C13H16ClN5O8S3/c1-26-13(10(22)19(11(13)28-3)30(23,24)25)17-9(21)8(18-27-2)6-5-29-12(15-6)16-7(20)4-14/h5,11H,4H2,1-3H3,(H,17,21)(H,15,16,20)(H,23,24,25)/p-1/b18-8+