bis[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl] (E)-but-2-enedioate

Systemtic Name: bis[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl] (E)-but-2-enedioate Openeye Name: bis[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic 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] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid bis[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl] ester Formula: C18H12N4O6S2 MolecularWeight: 444.44108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NOC(=N2)COC(=O)C=CC(=O)OCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1=CSC(=C1)C2=NOC(=N2)COC(=O)/C=C/C(=O)OCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C18H12N4O6S2/c23-15(25-9-13-19-17(21-27-13)11-3-1-7-29-11)5-6-16(24)26-10-14-20-18(22-28-14)12-4-2-8-30-12/h1-8H,9-10H2/b6-5+