2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-ethyl-pyrimidine

Systemtic Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-ethyl-pyrimidine Openeye Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-ethyl-pyrimidine CAS Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-ethylpyrimidine IUPAC Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-ethylpyrimidine Traditional Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-ethyl-pyrimidine Formula: C24H30N2 MolecularWeight: 346.5084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)CC

Isomeric SMILES

CCCCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)CC

InChI

InChI=1S/C24H30N2/c1-3-5-6-20-7-12-22(13-8-20)23-14-9-21(10-15-23)11-16-24-25-17-19(4-2)18-26-24/h9-10,14-15,17-18,20,22H,3-8,12-13H2,1-2H3