5-hexyl-2-[2-(4-pentylphenyl)ethynyl]pyrimidine

Systemtic Name: 5-hexyl-2-[2-(4-pentylphenyl)ethynyl]pyrimidine Openeye Name: 5-hexyl-2-[2-(4-pentylphenyl)ethynyl]pyrimidine CAS Name: 5-hexyl-2-[2-(4-pentylphenyl)ethynyl]pyrimidine IUPAC Name: 5-hexyl-2-[2-(4-pentylphenyl)ethynyl]pyrimidine Traditional Name: 2-[2-(4-amylphenyl)ethynyl]-5-hexyl-pyrimidine Formula: C23H30N2 MolecularWeight: 334.4977

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C23H30N2/c1-3-5-7-9-11-22-18-24-23(25-19-22)17-16-21-14-12-20(13-15-21)10-8-6-4-2/h12-15,18-19H,3-11H2,1-2H3