5-hexyl-2-[2-(4-pentoxyphenyl)pyrimidin-5-yl]pyrimidine

Systemtic Name: 5-hexyl-2-[2-(4-pentoxyphenyl)pyrimidin-5-yl]pyrimidine Openeye Name: 5-hexyl-2-[2-(4-pentoxyphenyl)pyrimidin-5-yl]pyrimidine CAS Name: 5-hexyl-2-[2-(4-pentoxyphenyl)-5-pyrimidinyl]pyrimidine IUPAC Name: 5-hexyl-2-[2-(4-pentoxyphenyl)pyrimidin-5-yl]pyrimidine Traditional Name: 2-(4-amoxyphenyl)-5-(5-hexylpyrimidin-2-yl)pyrimidine Formula: C25H32N4O MolecularWeight: 404.54778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OCCCCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OCCCCC

InChI

InChI=1S/C25H32N4O/c1-3-5-7-8-10-20-16-26-25(27-17-20)22-18-28-24(29-19-22)21-11-13-23(14-12-21)30-15-9-6-4-2/h11-14,16-19H,3-10,15H2,1-2H3