2-(3-bromanyl-4-butoxy-phenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine

Systemtic Name: 2-(3-bromanyl-4-butoxy-phenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine Openeye Name: 2-(3-bromo-4-butoxy-phenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine CAS Name: 2-(3-bromo-4-butoxyphenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine IUPAC Name: 2-(3-bromo-4-butoxyphenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine Traditional Name: 5-[(4-amylcyclohexyl)methoxy]-2-(3-bromo-4-butoxy-phenyl)pyrimidine Formula: C26H37BrN2O2 MolecularWeight: 489.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)COC2=CN=C(N=C2)C3=CC(=C(C=C3)OCCCC)Br

Isomeric SMILES

CCCCCC1CCC(CC1)COC2=CN=C(N=C2)C3=CC(=C(C=C3)OCCCC)Br

InChI

InChI=1S/C26H37BrN2O2/c1-3-5-7-8-20-9-11-21(12-10-20)19-31-23-17-28-26(29-18-23)22-13-14-25(24(27)16-22)30-15-6-4-2/h13-14,16-18,20-21H,3-12,15,19H2,1-2H3