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

Systemtic Name: 2-(3-bromanyl-2-butoxy-phenyl)-5-(4-pentylcyclohexyl)pyrimidine Openeye Name: 2-(3-bromo-2-butoxy-phenyl)-5-(4-pentylcyclohexyl)pyrimidine CAS Name: 2-(3-bromo-2-butoxyphenyl)-5-(4-pentylcyclohexyl)pyrimidine IUPAC Name: 2-(3-bromo-2-butoxyphenyl)-5-(4-pentylcyclohexyl)pyrimidine Traditional Name: 5-(4-amylcyclohexyl)-2-(3-bromo-2-butoxy-phenyl)pyrimidine Formula: C25H35BrN2O MolecularWeight: 459.4622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35BrN2O/c1-3-5-7-9-19-12-14-20(15-13-19)21-17-27-25(28-18-21)22-10-8-11-23(26)24(22)29-16-6-4-2/h8,10-11,17-20H,3-7,9,12-16H2,1-2H3