2-[2-(4-butoxyphenyl)ethynyl]-5-butyl-pyrimidine

Systemtic Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-butyl-pyrimidine Openeye Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-butyl-pyrimidine CAS Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-butylpyrimidine IUPAC Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-butylpyrimidine Traditional Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-butyl-pyrimidine Formula: C20H24N2O MolecularWeight: 308.41736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)OCCCC

Isomeric SMILES

CCCCC1=CN=C(N=C1)C#CC2=CC=C(C=C2)OCCCC

InChI

InChI=1S/C20H24N2O/c1-3-5-7-18-15-21-20(22-16-18)13-10-17-8-11-19(12-9-17)23-14-6-4-2/h8-9,11-12,15-16H,3-7,14H2,1-2H3