4-[[5-(pyridin-2-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[5-(pyridin-2-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-(2-pyridylmethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-(2-pyridinylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-(pyridin-2-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[5-(2-pyridylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile Formula: C16H12N4OS MolecularWeight: 308.35768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CC2=NN=C(O2)SCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=NC(=C1)CC2=NN=C(O2)SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N4OS/c17-10-12-4-6-13(7-5-12)11-22-16-20-19-15(21-16)9-14-3-1-2-8-18-14/h1-8H,9,11H2