[5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 5-nitrofuran-2-carboxylate

Systemtic Name: [5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 5-nitrofuran-2-carboxylate Openeye Name: [5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methyl 5-nitrofuran-2-carboxylate CAS Name: 5-nitro-2-furancarboxylic acid [5-(5-bromo-2-thiophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(5-bromothiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 5-nitrofuran-2-carboxylate Traditional Name: 5-nitrofuran-2-carboxylic acid [5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C12H6BrN3O6S MolecularWeight: 400.16154

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C2=NN=C(O2)COC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=C1)Br)C2=NN=C(O2)COC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C12H6BrN3O6S/c13-8-3-2-7(23-8)11-15-14-9(22-11)5-20-12(17)6-1-4-10(21-6)16(18)19/h1-4H,5H2