
 CHEMBL482178

 57 62  0  0  0  0  0  0  0  0999 V2000
    1.5988    0.4904    0.0120 C   0  0  0  0  0
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    2.8830   -0.1123  -14.9032 C   0  0  0  0  0
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    4.8495   -1.5828   -1.7393 H   0  0  0  0  0
    3.2220   -1.7930   -1.0353 H   0  0  0  0  0
    4.9547    1.6962   -2.2769 H   0  0  0  0  0
    3.3574    2.2298   -1.6840 H   0  0  0  0  0
    2.8748    2.2499   -4.4734 H   0  0  0  0  0
    1.9093   -1.7700   -5.7880 H   0  0  0  0  0
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  1  2  1  0  0  0
  1 37  1  0  0  0
  1 38  1  0  0  0
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  2  8  1  0  0  0
  2  3  1  0  0  0
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 36 57  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL482178

>  <PubChem CID>
44570498

>  <Formula>
C25H21N7O4

>  <Molecular Weight>
483.488000

>  <IUPAC Name>
N-[(2R)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-(2-oxo-3-pyrimidin-4-ylbenzimidazol-1-yl)acetamide

>  <XlogP>
1.1

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CN1C(=O)NC(=O)C12CC3=C(C2)C=C(C=C3)NC(=O)CN4C5=CC=CC=C5N(C4=O)C6=NC=NC=C6

>  <Isomeric SMILES>
CN1C(=O)NC(=O)[C@]12CC3=C(C2)C=C(C=C3)NC(=O)CN4C5=CC=CC=C5N(C4=O)C6=NC=NC=C6

>  <InChI Std. ID>
InChI=1S/C25H21N7O4/c1-30-23(35)29-22(34)25(30)11-15-6-7-17(10-16(15)12-25)28-21(33)13-31-18-4-2-3-5-19(18)32(24(31)36)20-8-9-26-14-27-20/h2-10,14H,11-13H2,1H3,(H,28,33)(H,29,34,35)/t25-/m1/s1

>  <InChI Key>
BBWASBWDVJQKBD-RUZDIDTESA-N

