5-butyl-2-[3-fluoranyl-4-[3-fluoranyl-4-(4-methylphenyl)phenyl]phenyl]pyrimidine

Systemtic Name: 5-butyl-2-[3-fluoranyl-4-[3-fluoranyl-4-(4-methylphenyl)phenyl]phenyl]pyrimidine Openeye Name: 5-butyl-2-[3-fluoro-4-[3-fluoro-4-(p-tolyl)phenyl]phenyl]pyrimidine CAS Name: 5-butyl-2-[3-fluoro-4-[3-fluoro-4-(4-methylphenyl)phenyl]phenyl]pyrimidine IUPAC Name: 5-butyl-2-[3-fluoro-4-[3-fluoro-4-(4-methylphenyl)phenyl]phenyl]pyrimidine Traditional Name: 5-butyl-2-[3-fluoro-4-[3-fluoro-4-(p-tolyl)phenyl]phenyl]pyrimidine Formula: C27H24F2N2 MolecularWeight: 414.489666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C3=CC(=C(C=C3)C4=CC=C(C=C4)C)F)F

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C3=CC(=C(C=C3)C4=CC=C(C=C4)C)F)F

InChI

InChI=1S/C27H24F2N2/c1-3-4-5-19-16-30-27(31-17-19)22-11-13-24(26(29)15-22)21-10-12-23(25(28)14-21)20-8-6-18(2)7-9-20/h6-17H,3-5H2,1-2H3