5-(4-methylphenyl)-7-(4-phenylmethoxyphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 5-(4-methylphenyl)-7-(4-phenylmethoxyphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 7-(4-benzyloxyphenyl)-5-(p-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 5-(4-methylphenyl)-7-(4-phenylmethoxyphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 5-(4-methylphenyl)-7-(4-phenylmethoxyphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 7-(4-benzoxyphenyl)-5-(p-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C25H22N4O MolecularWeight: 394.46838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(N3C(=N2)N=CN3)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(N3C(=N2)N=CN3)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H22N4O/c1-18-7-9-20(10-8-18)23-15-24(29-25(28-23)26-17-27-29)21-11-13-22(14-12-21)30-16-19-5-3-2-4-6-19/h2-15,17,24H,16H2,1H3,(H,26,27,28)