4-[5-(trans-4-Ethylcyclohexyl)-2-pyrimidinyl]benzonitrile

72785-11-6

CAS Name

4-[5-(trans-4-Ethylcyclohexyl)-2-pyrimidinyl]benzonitrile

Molecular Formula

C₁₉H₂₁N₃

Molecular Mass

291.39

Other Names and Identifiers

InChI

InChI=1/C19H21N3/c1-2-14-3-7-16(8-4-14)18-12-21-19(22-13-18)17-9-5-15(11-20)6-10-17/h5-6,9-10,12-14,16H,2-4,7-8H2,1H3/t14-,16-

InChIKey

InChIKey=YAZXDRDFNUEKBH-KOMQPUFPNA-N

SMILES

C(C)[C@H]1CC[C@H](C=2C=NC(=NC2)C3=CC=C(C#N)C=C3)CC1

Canonical SMILES

N#CC=1C=CC(=CC1)C2=NC=C(C=N2)C3CCC(CC)CC3

Other Names for this Substance