2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile

Systemtic Name: 2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile Openeye Name: 2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile CAS Name: 2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]thio]propanenitrile IUPAC Name: 2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanenitrile Traditional Name: 2-[[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]thio]propionitrile Formula: C13H13N3OS MolecularWeight: 259.32682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NN=C(O2)SC(C)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NN=C(O2)SC(C)C#N)C

InChI

InChI=1S/C13H13N3OS/c1-8-4-9(2)6-11(5-8)12-15-16-13(17-12)18-10(3)7-14/h4-6,10H,1-3H3