5-(4-butylphenyl)-2-(3-fluoranyl-4-hexyl-phenyl)pyrimidine

Systemtic Name: 5-(4-butylphenyl)-2-(3-fluoranyl-4-hexyl-phenyl)pyrimidine Openeye Name: 5-(4-butylphenyl)-2-(3-fluoro-4-hexyl-phenyl)pyrimidine CAS Name: 5-(4-butylphenyl)-2-(3-fluoro-4-hexylphenyl)pyrimidine IUPAC Name: 5-(4-butylphenyl)-2-(3-fluoro-4-hexylphenyl)pyrimidine Traditional Name: 5-(4-butylphenyl)-2-(3-fluoro-4-hexyl-phenyl)pyrimidine Formula: C26H31FN2 MolecularWeight: 390.536143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)CCCC)F

Isomeric SMILES

CCCCCCC1=C(C=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)CCCC)F

InChI

InChI=1S/C26H31FN2/c1-3-5-7-8-10-22-15-16-23(17-25(22)27)26-28-18-24(19-29-26)21-13-11-20(12-14-21)9-6-4-2/h11-19H,3-10H2,1-2H3