1-[2,3-bis(oxidanyl)propoxycarbonyloxy]ethyl 7-[[(2Z)-2-(5-azanyl-1,2,4-thiadiazol-3-yl)-2-(fluoranylmethoxyimino)ethanoyl]amino]-3-[(E)-[bis(azanyl)methylidenehydrazinylidene]methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 1-[2,3-bis(oxidanyl)propoxycarbonyloxy]ethyl 7-[[(2Z)-2-(5-azanyl-1,2,4-thiadiazol-3-yl)-2-(fluoranylmethoxyimino)ethanoyl]amino]-3-[(E)-[bis(azanyl)methylidenehydrazinylidene]methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 1-(2,3-dihydroxypropoxycarbonyloxy)ethyl 7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(fluoromethoxyimino)acetyl]amino]-3-[(E)-(diaminomethylenehydrazono)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(fluoromethoxyimino)-1-oxoethyl]amino]-3-[(E)-(diaminomethylidenehydrazinylidene)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 1-[2,3-dihydroxypropoxy(oxo)methoxy]ethyl ester IUPAC Name: 1-(2,3-dihydroxypropoxycarbonyloxy)ethyl 7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(fluoromethoxyimino)acetyl]amino]-3-[(E)-(diaminomethylidenehydrazinylidene)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(fluoromethyloximino)acetyl]amino]-3-[(E)-(diaminomethylenehydrazono)methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 1-glyceryloxycarbonyloxyethyl ester Formula: C20H25FN10O10S2 MolecularWeight: 648.601903

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC(=O)C1=C(CSC2N1C(=O)C2NC(=O)C(=NOCF)C3=NSC(=N3)N)C=NN=C(N)N)OC(=O)OCC(CO)O

Isomeric SMILES

CC(OC(=O)C1=C(CSC2N1C(=O)C2NC(=O)/C(=N\OCF)/C3=NSC(=N3)N)/C=N/N=C(N)N)OC(=O)OCC(CO)O

InChI

InChI=1S/C20H25FN10O10S2/c1-7(41-20(37)38-4-9(33)3-32)40-17(36)12-8(2-25-28-18(22)23)5-42-16-11(15(35)31(12)16)26-14(34)10(29-39-6-21)13-27-19(24)43-30-13/h2,7,9,11,16,32-33H,3-6H2,1H3,(H,26,34)(H4,22,23,28)(H2,24,27,30)/b25-2+,29-10-