diethyl 2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanedioate

Systemtic Name: diethyl 2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanedioate Openeye Name: diethyl 2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanedioate CAS Name: 2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanedioate Traditional Name: 2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]malonic acid diethyl ester Formula: C14H15N3O5S MolecularWeight: 337.351

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)SC1=NN=C(O1)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)SC1=NN=C(O1)C2=CC=NC=C2

InChI

InChI=1S/C14H15N3O5S/c1-3-20-12(18)10(13(19)21-4-2)23-14-17-16-11(22-14)9-5-7-15-8-6-9/h5-8,10H,3-4H2,1-2H3