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

Systemtic Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-propyl-pyrimidine Openeye Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-propyl-pyrimidine CAS Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-propylpyrimidine IUPAC Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-propylpyrimidine Traditional Name: 2-[2-[4-(4-butylcyclohexyl)phenyl]ethynyl]-5-propyl-pyrimidine Formula: C25H32N2 MolecularWeight: 360.53498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2/c1-3-5-7-20-8-13-23(14-9-20)24-15-10-21(11-16-24)12-17-25-26-18-22(6-4-2)19-27-25/h10-11,15-16,18-20,23H,3-9,13-14H2,1-2H3