acetyloxymethyl 6-(1-hydroxyethyl)-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: acetyloxymethyl 6-(1-hydroxyethyl)-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: acetoxymethyl 6-(1-hydroxyethyl)-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(1-hydroxyethyl)-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 6-(1-hydroxyethyl)-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(1-hydroxyethyl)-7-keto-3-[[(1-methyltetrazol-5-yl)thio]methyl]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid acetoxymethyl ester Formula: C14H17N5O6S2 MolecularWeight: 415.44468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)CSC3=NN=NN3C)C(=O)OCOC(=O)C)O

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)CSC3=NN=NN3C)C(=O)OCOC(=O)C)O

InChI

InChI=1S/C14H17N5O6S2/c1-6(20)9-11(22)19-10(13(23)25-5-24-7(2)21)8(27-12(9)19)4-26-14-15-16-17-18(14)3/h6,9,12,20H,4-5H2,1-3H3