prop-2-enyl 6-bromanyl-3,3-dimethyl-6-[2-(1-methylimidazol-2-yl)-1-oxidanyl-2-oxidanylidene-ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: prop-2-enyl 6-bromanyl-3,3-dimethyl-6-[2-(1-methylimidazol-2-yl)-1-oxidanyl-2-oxidanylidene-ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: allyl 6-bromo-6-[1-hydroxy-2-(1-methylimidazol-2-yl)-2-oxo-ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-6-[1-hydroxy-2-(1-methyl-2-imidazolyl)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-bromo-6-[1-hydroxy-2-(1-methylimidazol-2-yl)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-6-[1-hydroxy-2-keto-2-(1-methylimidazol-2-yl)ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid allyl ester Formula: C17H20BrN3O5S MolecularWeight: 458.3268

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(C(C(=O)C3=NC=CN3C)O)Br)C(=O)OCC=C)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(C(C(=O)C3=NC=CN3C)O)Br)C(=O)OCC=C)C

InChI

InChI=1S/C17H20BrN3O5S/c1-5-8-26-13(24)10-16(2,3)27-15-17(18,14(25)21(10)15)11(23)9(22)12-19-6-7-20(12)4/h5-7,10-11,15,23H,1,8H2,2-4H3