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

Systemtic Name: 2-[2-(4-pentylphenyl)ethynyl]-5-propyl-pyrimidine Openeye Name: 2-[2-(4-pentylphenyl)ethynyl]-5-propyl-pyrimidine CAS Name: 2-[2-(4-pentylphenyl)ethynyl]-5-propylpyrimidine IUPAC Name: 2-[2-(4-pentylphenyl)ethynyl]-5-propylpyrimidine Traditional Name: 2-[2-(4-amylphenyl)ethynyl]-5-propyl-pyrimidine Formula: C20H24N2 MolecularWeight: 292.41796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)CCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)CCC

InChI

InChI=1S/C20H24N2/c1-3-5-6-8-17-9-11-18(12-10-17)13-14-20-21-15-19(7-4-2)16-22-20/h9-12,15-16H,3-8H2,1-2H3