5-methoxy-2-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]pyrimidine

Systemtic Name: 5-methoxy-2-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]pyrimidine Openeye Name: 5-methoxy-2-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]pyrimidine CAS Name: 5-methoxy-2-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]pyrimidine IUPAC Name: 5-methoxy-2-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]pyrimidine Traditional Name: 5-methoxy-2-[2-[4-(4-methylcyclohexyl)phenyl]ethynyl]pyrimidine Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)OC

Isomeric SMILES

CC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)OC

InChI

InChI=1S/C20H22N2O/c1-15-3-8-17(9-4-15)18-10-5-16(6-11-18)7-12-20-21-13-19(23-2)14-22-20/h5-6,10-11,13-15,17H,3-4,8-9H2,1-2H3