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8-butyl-7-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]purine

8-butyl-7-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]purine

Systemtic Name:8-butyl-7-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]purine
Openeye Name:8-butyl-7-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]purine
CAS Name:8-butyl-7-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]purine
IUPAC Name:8-butyl-7-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]purine
Traditional Name:8-butyl-7-[4-phenyl-3-(2H-tetrazol-5-yl)benzyl]purine
Formula: C23H22N8
MolecularWeight: 410.47438
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=NC=NC=C2N1CC3=CC(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5


Isomeric SMILES

CCCCC1=NC2=NC=NC=C2N1CC3=CC(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5


InChI

InChI=1S/C23H22N8/c1-2-3-9-21-26-23-20(13-24-15-25-23)31(21)14-16-10-11-18(17-7-5-4-6-8-17)19(12-16)22-27-29-30-28-22/h4-8,10-13,15H,2-3,9,14H2,1H3,(H,27,28,29,30)


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