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

Systemtic Name: 3-[3-[chloranyl(pyrimidin-5-yl)methyl]-5-(2-cyanopropyl)phenyl]-2-methyl-propanenitrile Openeye Name: 3-[3-[chloro(pyrimidin-5-yl)methyl]-5-(2-cyanopropyl)phenyl]-2-methyl-propanenitrile CAS Name: 3-[3-[chloro(5-pyrimidinyl)methyl]-5-(2-cyanopropyl)phenyl]-2-methylpropanenitrile IUPAC Name: 3-[3-[chloro(pyrimidin-5-yl)methyl]-5-(2-cyanopropyl)phenyl]-2-methylpropanenitrile Traditional Name: 3-[3-[chloro(5-pyrimidyl)methyl]-5-(2-cyanopropyl)phenyl]-2-methyl-propionitrile Formula: C19H19ClN4 MolecularWeight: 338.83396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN4/c1-13(8-21)3-15-5-16(4-14(2)9-22)7-17(6-15)19(20)18-10-23-12-24-11-18/h5-7,10-14,19H,3-4H2,1-2H3