
 CHEMBL179499

 66 69  0  0  0  0  0  0  0  0999 V2000
    5.8622   -1.6274   -1.5591 C   0  0  0  0  0
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    7.6495    2.5805    0.9359 N   0  0  0  0  0
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    4.0066    0.3549   -1.9423 H   0  0  0  0  0
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    1.0081    2.3010    1.4947 H   0  0  0  0  0
    1.1033   -0.8330    1.3341 H   0  0  0  0  0
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    7.1323    3.9317    2.4249 H   0  0  0  0  0
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    8.8923    1.9888    3.6772 H   0  0  0  0  0
    9.2963    3.6672    3.2593 H   0  0  0  0  0
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   13.9117    3.6873    0.3385 H   0  0  0  0  0
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    7.2943    4.3476   -4.0432 H   0  0  0  0  0
    8.0867    4.8500   -2.5386 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL179499

>  <PubChem CID>
20780250

>  <Formula>
C25H36N4O

>  <Molecular Weight>
408.590000

>  <IUPAC Name>
N-(2-cyclopropylethyl)-6-ethyl-N-propyl-1-(2,4,6-trimethylphenyl)-2,3-dihydroimidazo[1,2-a]imidazole-5-carboxamide

>  <XlogP>
5.8

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CCCN(CCC1CC1)C(=O)C2=C(N=C3N2CCN3C4=C(C=C(C=C4C)C)C)CC

>  <Isomeric SMILES>
CCCN(CCC1CC1)C(=O)C2=C(N=C3N2CCN3C4=C(C=C(C=C4C)C)C)CC

>  <InChI Std. ID>
InChI=1S/C25H36N4O/c1-6-11-27(12-10-20-8-9-20)24(30)23-21(7-2)26-25-28(13-14-29(23)25)22-18(4)15-17(3)16-19(22)5/h15-16,20H,6-14H2,1-5H3

>  <InChI Key>
AZOQHJDSUKZHKB-UHFFFAOYSA-N

