2-[4-[(4-chloranyl-2-methyl-6-pentyl-pyrimidin-5-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(4-chloranyl-2-methyl-6-pentyl-pyrimidin-5-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(4-chloro-2-methyl-6-pentyl-pyrimidin-5-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(4-chloro-2-methyl-6-pentyl-5-pyrimidinyl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(4-chloro-2-methyl-6-pentylpyrimidin-5-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(4-amyl-6-chloro-2-methyl-pyrimidin-5-yl)methyl]phenyl]benzonitrile Formula: C24H24ClN3 MolecularWeight: 389.92046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=NC(=N1)C)Cl)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CCCCCC1=C(C(=NC(=N1)C)Cl)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C24H24ClN3/c1-3-4-5-10-23-22(24(25)28-17(2)27-23)15-18-11-13-19(14-12-18)21-9-7-6-8-20(21)16-26/h6-9,11-14H,3-5,10,15H2,1-2H3