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

Systemtic Name: prop-2-enyl 6-[2-(2-benzothiophen-1-yl)-1-oxidanyl-2-oxidanylidene-ethyl]-6-bromanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: allyl 6-[2-(2-benzothiophen-1-yl)-1-hydroxy-2-oxo-ethyl]-6-bromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-[2-(2-benzothiophen-1-yl)-1-hydroxy-2-oxoethyl]-6-bromo-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-[2-(2-benzothiophen-1-yl)-1-hydroxy-2-oxoethyl]-6-bromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-6-(1-hydroxy-2-isobenzothiophen-1-yl-2-keto-ethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid allyl ester Formula: C21H20BrNO5S2 MolecularWeight: 510.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(C(C(=O)C3=C4C=CC=CC4=CS3)O)Br)C(=O)OCC=C)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(C(C(=O)C3=C4C=CC=CC4=CS3)O)Br)C(=O)OCC=C)C

InChI

InChI=1S/C21H20BrNO5S2/c1-4-9-28-17(26)15-20(2,3)30-19-21(22,18(27)23(15)19)16(25)13(24)14-12-8-6-5-7-11(12)10-29-14/h4-8,10,15-16,19,25H,1,9H2,2-3H3