3-[3-(2-cyanopropyl)-5-(pyrimidin-5-ylmethyl)phenyl]-2-methyl-propanenitrile

Systemtic Name: 3-[3-(2-cyanopropyl)-5-(pyrimidin-5-ylmethyl)phenyl]-2-methyl-propanenitrile Openeye Name: 3-[3-(2-cyanopropyl)-5-(pyrimidin-5-ylmethyl)phenyl]-2-methyl-propanenitrile CAS Name: 3-[3-(2-cyanopropyl)-5-(5-pyrimidinylmethyl)phenyl]-2-methylpropanenitrile IUPAC Name: 3-[3-(2-cyanopropyl)-5-(pyrimidin-5-ylmethyl)phenyl]-2-methylpropanenitrile Traditional Name: 3-[3-(2-cyanopropyl)-5-(5-pyrimidylmethyl)phenyl]-2-methyl-propionitrile Formula: C19H20N4 MolecularWeight: 304.3889

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC(=C1)CC2=CN=CN=C2)CC(C)C#N)C#N

Isomeric SMILES

CC(CC1=CC(=CC(=C1)CC2=CN=CN=C2)CC(C)C#N)C#N

InChI

InChI=1S/C19H20N4/c1-14(9-20)3-16-5-17(4-15(2)10-21)7-18(6-16)8-19-11-22-13-23-12-19/h5-7,11-15H,3-4,8H2,1-2H3