
 N-(1H-benzimidazol-2-yl)-3-chlorobenzamide

 29 31  0  0  0  0  0  0  0  0999 V2000
    1.4185   -0.4522   -3.6524 C   0  0  0  0  0
    1.8919   -1.6110   -3.0306 C   0  0  0  0  0
    1.1857   -2.1973   -1.9730 C   0  0  0  0  0
   -0.0070   -1.5957   -1.5463 C   0  0  0  0  0
   -0.4484   -0.4370   -2.1780 C   0  0  0  0  0
    0.2317    0.1649   -3.2380 C   0  0  0  0  0
   -1.6040   -0.1179   -1.5155 N   0  0  0  0  0
   -1.8206   -1.0684   -0.5519 C   0  0  0  0  0
   -0.8735   -1.9764   -0.5491 N   0  0  0  0  0
   -2.8920   -1.0805    0.3022 N   0  0  0  0  0
   -3.8630   -0.1031    0.2934 C   0  0  0  0  0
   -3.8670    0.8549   -0.4762 O   0  0  0  0  0
   -4.9806   -0.2620    1.2758 C   0  0  0  0  0
   -4.9078   -1.1162    2.3839 C   0  0  0  0  0
   -6.0028   -1.2330    3.2427 C   0  0  0  0  0
   -7.1659   -0.4984    3.0228 C   0  0  0  0  0
   -7.2367    0.3710    1.9366 C   0  0  0  0  0
   -6.1487    0.4896    1.0683 C   0  0  0  0  0
   -5.9135   -2.3000    4.5913 Cl  0  0  0  0  0
    1.9849   -0.0192   -4.4749 H   0  0  0  0  0
    2.8192   -2.0660   -3.3709 H   0  0  0  0  0
    1.5458   -3.0967   -1.4870 H   0  0  0  0  0
   -0.1345    1.0651   -3.7195 H   0  0  0  0  0
   -2.2193    0.6681   -1.6834 H   0  0  0  0  0
   -2.9176   -1.8859    0.9087 H   0  0  0  0  0
   -4.0130   -1.6852    2.6118 H   0  0  0  0  0
   -8.0150   -0.5947    3.6950 H   0  0  0  0  0
   -8.1376    0.9550    1.7629 H   0  0  0  0  0
   -6.2194    1.1715    0.2217 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 20  1  0  0  0
  2  3  1  0  0  0
  2 21  1  0  0  0
  3  4  2  0  0  0
  3 22  1  0  0  0
  4  9  1  0  0  0
  4  5  1  0  0  0
  5  7  1  0  0  0
  5  6  2  0  0  0
  6 23  1  0  0  0
  7  8  1  0  0  0
  7 24  1  0  0  0
  8  9  2  0  0  0
  8 10  1  0  0  0
 10 11  1  0  0  0
 10 25  1  0  0  0
 11 13  1  0  0  0
 11 12  2  0  0  0
 13 14  2  0  0  0
 13 18  1  0  0  0
 14 15  1  0  0  0
 14 26  1  0  0  0
 15 16  2  0  0  0
 15 19  1  0  0  0
 16 17  1  0  0  0
 16 27  1  0  0  0
 17 18  2  0  0  0
 17 28  1  0  0  0
 18 29  1  0  0  0
M  END

>  <Chemical Name>
N-(1H-benzimidazol-2-yl)-3-chlorobenzamide

>  <PubChem CID>
898010

>  <Formula>
C14H10ClN3O

>  <Molecular Weight>
271.704000

>  <IUPAC Name>
N-(1H-benzimidazol-2-yl)-3-chlorobenzamide

>  <XlogP>
3.400

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC(=CC=C3)Cl

>  <Isomeric SMILES>
C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC(=CC=C3)Cl

>  <InChI Std. ID>
InChI=1S/C14H10ClN3O/c15-10-5-3-4-9(8-10)13(19)18-14-16-11-6-1-2-7-12(11)17-14/h1-8H,(H2,16,17,18,19)

>  <InChI Key>
NNOLHIYETJFEDS-UHFFFAOYSA-N

