5-methyl-2-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]pyrimidine

Systemtic Name: 5-methyl-2-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]pyrimidine Openeye Name: 5-methyl-2-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]pyrimidine CAS Name: 5-methyl-2-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]pyrimidine IUPAC Name: 5-methyl-2-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]pyrimidine Traditional Name: 5-methyl-2-[2-[4-(4-propylcyclohexyl)phenyl]ethynyl]pyrimidine Formula: C22H26N2 MolecularWeight: 318.45524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)C

Isomeric SMILES

CCCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)C

InChI

InChI=1S/C22H26N2/c1-3-4-18-5-10-20(11-6-18)21-12-7-19(8-13-21)9-14-22-23-15-17(2)16-24-22/h7-8,12-13,15-16,18,20H,3-6,10-11H2,1-2H3