4-[[5-(2-azanylethyl)imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-(2-azanylethyl)imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-(2-aminoethyl)imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-(2-aminoethyl)-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-(2-aminoethyl)imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-(2-aminoethyl)imidazol-1-yl]methyl]benzonitrile Formula: C13H14N4 MolecularWeight: 226.27706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC=C2CCN)C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC=C2CCN)C#N

InChI

InChI=1S/C13H14N4/c14-6-5-13-8-16-10-17(13)9-12-3-1-11(7-15)2-4-12/h1-4,8,10H,5-6,9,14H2