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

Systemtic Name: 2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC=CC=C3C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C17H13N3O2S/c1-21-15-8-6-12(7-9-15)16-19-20-17(22-16)23-11-14-5-3-2-4-13(14)10-18/h2-9H,11H2,1H3