4-butyl-6-ethyl-2-methyl-5-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidine

Systemtic Name: 4-butyl-6-ethyl-2-methyl-5-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidine Openeye Name: 4-butyl-6-ethyl-2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidine CAS Name: 4-butyl-6-ethyl-2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidine IUPAC Name: 4-butyl-6-ethyl-2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidine Traditional Name: 4-butyl-6-ethyl-2-methyl-5-[4-phenyl-3-(2H-tetrazol-5-yl)benzyl]pyrimidine Formula: C25H28N6 MolecularWeight: 412.53002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NC(=C1CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4)CC)C

Isomeric SMILES

CCCCC1=NC(=NC(=C1CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4)CC)C

InChI

InChI=1S/C25H28N6/c1-4-6-12-24-22(23(5-2)26-17(3)27-24)16-18-13-14-20(19-10-8-7-9-11-19)21(15-18)25-28-30-31-29-25/h7-11,13-15H,4-6,12,16H2,1-3H3,(H,28,29,30,31)