5-[2-(4-butylcyclohexyl)ethynyl]-2-(4-chlorophenyl)pyrimidine

Systemtic Name: 5-[2-(4-butylcyclohexyl)ethynyl]-2-(4-chlorophenyl)pyrimidine Openeye Name: 5-[2-(4-butylcyclohexyl)ethynyl]-2-(4-chlorophenyl)pyrimidine CAS Name: 5-[2-(4-butylcyclohexyl)ethynyl]-2-(4-chlorophenyl)pyrimidine IUPAC Name: 5-[2-(4-butylcyclohexyl)ethynyl]-2-(4-chlorophenyl)pyrimidine Traditional Name: 5-[2-(4-butylcyclohexyl)ethynyl]-2-(4-chlorophenyl)pyrimidine Formula: C22H25ClN2 MolecularWeight: 352.9003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C#CC2=CN=C(N=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC1CCC(CC1)C#CC2=CN=C(N=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2/c1-2-3-4-17-5-7-18(8-6-17)9-10-19-15-24-22(25-16-19)20-11-13-21(23)14-12-20/h11-18H,2-8H2,1H3