bis[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl] benzene-1,4-dicarboxylate

Systemtic Name: bis[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl] benzene-1,4-dicarboxylate Openeye Name: bis[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid bis[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl] ester IUPAC Name: bis[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid bis[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl] ester Formula: C22H14N4O6S2 MolecularWeight: 494.49976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)C(=O)OCC4=NC(=NO4)C5=CC=CS5

Isomeric SMILES

C1=CSC(=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)C(=O)OCC4=NC(=NO4)C5=CC=CS5

InChI

InChI=1S/C22H14N4O6S2/c27-21(29-11-17-23-19(25-31-17)15-3-1-9-33-15)13-5-7-14(8-6-13)22(28)30-12-18-24-20(26-32-18)16-4-2-10-34-16/h1-10H,11-12H2