2-(4-butoxy-3-chloranyl-phenyl)-5-(4-pentylphenyl)pyrimidine

Systemtic Name: 2-(4-butoxy-3-chloranyl-phenyl)-5-(4-pentylphenyl)pyrimidine Openeye Name: 2-(4-butoxy-3-chloro-phenyl)-5-(4-pentylphenyl)pyrimidine CAS Name: 2-(4-butoxy-3-chlorophenyl)-5-(4-pentylphenyl)pyrimidine IUPAC Name: 2-(4-butoxy-3-chlorophenyl)-5-(4-pentylphenyl)pyrimidine Traditional Name: 5-(4-amylphenyl)-2-(4-butoxy-3-chloro-phenyl)pyrimidine Formula: C25H29ClN2O MolecularWeight: 408.96356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)OCCCC)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)OCCCC)Cl

InChI

InChI=1S/C25H29ClN2O/c1-3-5-7-8-19-9-11-20(12-10-19)22-17-27-25(28-18-22)21-13-14-24(23(26)16-21)29-15-6-4-2/h9-14,16-18H,3-8,15H2,1-2H3