2-[2-(4-butylphenyl)ethynyl]-5-ethyl-pyrimidine

Systemtic Name: 2-[2-(4-butylphenyl)ethynyl]-5-ethyl-pyrimidine Openeye Name: 2-[2-(4-butylphenyl)ethynyl]-5-ethyl-pyrimidine CAS Name: 2-[2-(4-butylphenyl)ethynyl]-5-ethylpyrimidine IUPAC Name: 2-[2-(4-butylphenyl)ethynyl]-5-ethylpyrimidine Traditional Name: 2-[2-(4-butylphenyl)ethynyl]-5-ethyl-pyrimidine Formula: C18H20N2 MolecularWeight: 264.3648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)CC

InChI

InChI=1S/C18H20N2/c1-3-5-6-16-7-9-17(10-8-16)11-12-18-19-13-15(4-2)14-20-18/h7-10,13-14H,3-6H2,1-2H3