5-hexyl-2-[6-(4-pentoxyphenyl)pyridin-3-yl]pyrimidine

Systemtic Name: 5-hexyl-2-[6-(4-pentoxyphenyl)pyridin-3-yl]pyrimidine Openeye Name: 5-hexyl-2-[6-(4-pentoxyphenyl)-3-pyridyl]pyrimidine CAS Name: 5-hexyl-2-[6-(4-pentoxyphenyl)-3-pyridinyl]pyrimidine IUPAC Name: 5-hexyl-2-[6-(4-pentoxyphenyl)pyridin-3-yl]pyrimidine Traditional Name: 2-[6-(4-amoxyphenyl)-3-pyridyl]-5-hexyl-pyrimidine Formula: C26H33N3O MolecularWeight: 403.55972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O/c1-3-5-7-8-10-21-18-28-26(29-19-21)23-13-16-25(27-20-23)22-11-14-24(15-12-22)30-17-9-6-4-2/h11-16,18-20H,3-10,17H2,1-2H3