3-[[(1-imidazol-1-yl-3,3-dimethyl-butan-2-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[(1-imidazol-1-yl-3,3-dimethyl-butan-2-yl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[[[1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]amino]methyl]benzonitrile CAS Name: 3-[[[1-(1-imidazolyl)-3,3-dimethylbutan-2-yl]amino]methyl]benzonitrile IUPAC Name: 3-[[(1-imidazol-1-yl-3,3-dimethylbutan-2-yl)amino]methyl]benzonitrile Traditional Name: 3-[[[1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]amino]methyl]benzonitrile Formula: C17H22N4 MolecularWeight: 282.38338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CN=C1)NCC2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)(C)C(CN1C=CN=C1)NCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H22N4/c1-17(2,3)16(12-21-8-7-19-13-21)20-11-15-6-4-5-14(9-15)10-18/h4-9,13,16,20H,11-12H2,1-3H3