4-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl furan-2-carboxylate

Systemtic Name: 4-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl furan-2-carboxylate Openeye Name: 4-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl furan-2-carboxylate CAS Name: 2-furancarboxylic acid 4-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]but-2-ynyl ester IUPAC Name: 4-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl furan-2-carboxylate Traditional Name: furan-2-carboxylic acid 4-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]but-2-ynyl ester Formula: C17H12N2O4S MolecularWeight: 340.35318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(O2)SCC#CCOC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(O2)SCC#CCOC(=O)C3=CC=CO3

InChI

InChI=1S/C17H12N2O4S/c20-16(14-9-6-11-21-14)22-10-4-5-12-24-17-19-18-15(23-17)13-7-2-1-3-8-13/h1-3,6-9,11H,10,12H2