
 CHEMBL468525

 38 40  0  0  0  0  0  0  0  0999 V2000
   -0.0982   -2.1483    2.1931 C   0  0  0  0  0
    1.3804   -2.3340    2.3614 C   0  0  0  0  0
    1.9517   -3.4034    1.7509 N   0  0  0  0  0
    3.2930   -3.5363    1.8372 C   0  0  0  0  0
    4.0828   -2.6612    2.5721 C   0  0  0  0  0
    3.4797   -1.5848    3.2153 C   0  0  0  0  0
    2.1088   -1.4091    3.1012 C   0  0  0  0  0
    3.8071   -4.6307    1.1310 N   0  0  0  0  0
    5.1247   -4.8202    0.7777 C   0  0  0  0  0
    6.0409   -4.0282    0.9778 O   0  0  0  0  0
    5.4463   -6.0800    0.0535 C   0  0  0  0  0
    6.5398   -6.0690   -0.8186 C   0  0  0  0  0
    6.9622   -7.2454   -1.4439 C   0  0  0  0  0
    6.3072   -8.4696   -1.2224 C   0  0  0  0  0
    5.1922   -8.4542   -0.3597 C   0  0  0  0  0
    4.7664   -7.2786    0.2786 C   0  0  0  0  0
    6.8024   -9.7215   -1.8429 C   0  0  0  0  0
    6.7691  -10.9461   -1.1505 C   0  0  0  0  0
    7.2637  -12.1175   -1.7309 C   0  0  0  0  0
    7.8146  -12.0994   -3.0077 C   0  0  0  0  0
    7.8625  -10.9014   -3.7132 C   0  0  0  0  0
    7.3557   -9.7306   -3.1388 C   0  0  0  0  0
    7.1965  -13.5975   -0.8538 Cl  0  0  0  0  0
   -0.5219   -2.9358    1.5625 H   0  0  0  0  0
   -0.3020   -1.1843    1.7154 H   0  0  0  0  0
   -0.5978   -2.1786    3.1661 H   0  0  0  0  0
    5.1533   -2.7947    2.6703 H   0  0  0  0  0
    4.0822   -0.8870    3.7892 H   0  0  0  0  0
    1.6227   -0.5630    3.5763 H   0  0  0  0  0
    3.0837   -5.2051    0.7224 H   0  0  0  0  0
    7.0883   -5.1452   -0.9962 H   0  0  0  0  0
    7.8418   -7.1931   -2.0826 H   0  0  0  0  0
    4.6437   -9.3725   -0.1578 H   0  0  0  0  0
    3.9370   -7.3321    0.9783 H   0  0  0  0  0
    6.3743  -10.9937   -0.1385 H   0  0  0  0  0
    8.2069  -13.0086   -3.4547 H   0  0  0  0  0
    8.2937  -10.8737   -4.7110 H   0  0  0  0  0
    7.3976   -8.8151   -3.7264 H   0  0  0  0  0
  1  2  1  0  0  0
  1 24  1  0  0  0
  1 25  1  0  0  0
  1 26  1  0  0  0
  2  3  2  0  0  0
  2  7  1  0  0  0
  3  4  1  0  0  0
  4  5  2  0  0  0
  4  8  1  0  0  0
  5  6  1  0  0  0
  5 27  1  0  0  0
  6  7  2  0  0  0
  6 28  1  0  0  0
  7 29  1  0  0  0
  8  9  1  0  0  0
  8 30  1  0  0  0
  9 11  1  0  0  0
  9 10  2  0  0  0
 11 12  2  0  0  0
 11 16  1  0  0  0
 12 13  1  0  0  0
 12 31  1  0  0  0
 13 14  2  0  0  0
 13 32  1  0  0  0
 14 15  1  0  0  0
 14 17  1  0  0  0
 15 16  2  0  0  0
 15 33  1  0  0  0
 16 34  1  0  0  0
 17 18  2  0  0  0
 17 22  1  0  0  0
 18 19  1  0  0  0
 18 35  1  0  0  0
 19 20  2  0  0  0
 19 23  1  0  0  0
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 21 37  1  0  0  0
 22 38  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL468525

>  <PubChem CID>
44158090

>  <Formula>
C19H15ClN2O

>  <Molecular Weight>
322.792000

>  <IUPAC Name>
4-(3-chlorophenyl)-N-(6-methylpyridin-2-yl)benzamide

>  <XlogP>
4.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
CC1=NC(=CC=C1)NC(=O)C2=CC=C(C=C2)C3=CC(=CC=C3)Cl

>  <Isomeric SMILES>
CC1=NC(=CC=C1)NC(=O)C2=CC=C(C=C2)C3=CC(=CC=C3)Cl

>  <InChI Std. ID>
InChI=1S/C19H15ClN2O/c1-13-4-2-7-18(21-13)22-19(23)15-10-8-14(9-11-15)16-5-3-6-17(20)12-16/h2-12H,1H3,(H,21,22,23)

>  <InChI Key>
IVAREHJIGRSXHE-UHFFFAOYSA-N

