2-(4-butoxyphenyl)-5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]pyrimidine

Systemtic Name: 2-(4-butoxyphenyl)-5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]pyrimidine Openeye Name: 2-(4-butoxyphenyl)-5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]pyrimidine CAS Name: 2-(4-butoxyphenyl)-5-[4-(2-fluoro-4-methylpentoxy)phenyl]pyrimidine IUPAC Name: 2-(4-butoxyphenyl)-5-[4-(2-fluoro-4-methylpentoxy)phenyl]pyrimidine Traditional Name: 2-(4-butoxyphenyl)-5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]pyrimidine Formula: C26H31FN2O2 MolecularWeight: 422.534943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C26H31FN2O2/c1-4-5-14-30-24-12-8-21(9-13-24)26-28-16-22(17-29-26)20-6-10-25(11-7-20)31-18-23(27)15-19(2)3/h6-13,16-17,19,23H,4-5,14-15,18H2,1-3H3