3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanenitrile

Systemtic Name: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanenitrile Openeye Name: 3-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanenitrile CAS Name: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]propanenitrile IUPAC Name: 3-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]propanenitrile Traditional Name: 3-[4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]propionitrile Formula: C17H21N5O MolecularWeight: 311.38154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)CCC#N

InChI

InChI=1S/C17H21N5O/c1-14-3-5-15(6-4-14)17-19-16(23-20-17)13-22-11-9-21(10-12-22)8-2-7-18/h3-6H,2,8-13H2,1H3