
 L-158338

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    6.5844   -4.8146   -1.0430 C   0  0  0  0  0
    7.0883   -3.5859   -0.6959 N   0  0  0  0  0
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    4.2252   -5.5407   -3.9372 C   0  0  0  0  0
    8.3521    1.1027   -1.6181 H   0  0  0  0  0
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    8.3008    1.2312   -3.3848 H   0  0  0  0  0
    8.5195   -1.1449   -2.6627 H   0  0  0  0  0
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M  END

>  <Chemical Name>
L-158338

>  <PubChem CID>
3036053

>  <Formula>
C24H23N7

>  <Molecular Weight>
409.497000

>  <IUPAC Name>
7-methyl-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazo[4,5-b]pyridine

>  <XlogP>
4.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CCCC1=NC2=C(C=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C

>  <Isomeric SMILES>
CCCC1=NC2=C(C=CN=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C

>  <InChI Std. ID>
InChI=1S/C24H23N7/c1-3-6-21-26-22-16(2)13-14-25-24(22)31(21)15-17-9-11-18(12-10-17)19-7-4-5-8-20(19)23-27-29-30-28-23/h4-5,7-14H,3,6,15H2,1-2H3,(H,27,28,29,30)

>  <InChI Key>
CYUMNDVYHILLEX-UHFFFAOYSA-N

