2-(4-tert-butylphenyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-(4-tert-butylphenyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 2-(4-tert-butylphenyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine CAS Name: 2-(4-tert-butylphenyl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine IUPAC Name: 2-(4-tert-butylphenyl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine Traditional Name: 2-(4-tert-butylphenyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine Formula: C28H25N3 MolecularWeight: 403.5182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN3C(=CC(=NC3=C2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN3C(=CC(=NC3=C2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H25N3/c1-28(2,3)23-16-14-21(15-17-23)25-19-27-29-24(20-10-6-4-7-11-20)18-26(31(27)30-25)22-12-8-5-9-13-22/h4-19H,1-3H3