2-[3-(2-cyanopropan-2-yl)-5-(imidazol-1-ylmethyl)phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[3-(2-cyanopropan-2-yl)-5-(imidazol-1-ylmethyl)phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-(imidazol-1-ylmethyl)phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(2-cyanopropan-2-yl)-5-(1-imidazolylmethyl)phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-(imidazol-1-ylmethyl)phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-(imidazol-1-ylmethyl)phenyl]-2-methyl-propionitrile Formula: C18H20N4 MolecularWeight: 292.3782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC(=CC(=C1)CN2C=CN=C2)C(C)(C)C#N

Isomeric SMILES

CC(C)(C#N)C1=CC(=CC(=C1)CN2C=CN=C2)C(C)(C)C#N

InChI

InChI=1S/C18H20N4/c1-17(2,11-19)15-7-14(10-22-6-5-21-13-22)8-16(9-15)18(3,4)12-20/h5-9,13H,10H2,1-4H3