(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 5-(4-ethanoylphenyl)furan-2-carboxylate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 5-(4-ethanoylphenyl)furan-2-carboxylate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 5-(4-acetylphenyl)furan-2-carboxylate CAS Name: 5-(4-acetylphenyl)-2-furancarboxylic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 5-(4-acetylphenyl)furan-2-carboxylate Traditional Name: 5-(4-acetylphenyl)furan-2-carboxylic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H14N2O5S MolecularWeight: 394.40056

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)OCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)OCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C20H14N2O5S/c1-12(23)13-2-4-14(5-3-13)16-6-7-17(26-16)20(24)25-10-18-21-19(22-27-18)15-8-9-28-11-15/h2-9,11H,10H2,1H3