67968048
  -OEChem-05032423322D

 49 52  0     0  0  0  0  0  0999 V2000
   12.1279   -3.0981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6279    1.2320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.5981    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5443    1.2933    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1279    0.3660    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1279    2.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    1.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1279    2.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5443    2.9028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    1.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    3.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6279    1.2320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6279    1.2320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6279    2.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6279   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1279   -1.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1279    2.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6279    2.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1279    0.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6279   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6279   -2.2320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6279   -2.2320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1279   -1.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1279   -1.3660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1279   -3.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7369    3.4921    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.4781    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    3.7181    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3179    0.6951    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3291    2.9081    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3179    3.5010    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7479    2.0981    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8179   -0.1709    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9379    3.5010    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900    1.6350    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631    0.7881    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    0.5611    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9379    0.0369    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3179   -2.7690    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7479   -1.3660    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1279   -0.7460    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5079   -1.3660    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1279   -1.9860    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1279   -3.7181    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7479   -3.0981    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1279   -2.4781    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 25  1  0  0  0  0
  1 28  1  0  0  0  0
  2 21  2  0  0  0  0
  3  7  1  0  0  0  0
  3  9  1  0  0  0  0
  3 12  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  2  0  0  0  0
  5 14  1  0  0  0  0
  5 21  1  0  0  0  0
  5 36  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  8 13  2  0  0  0  0
  8 16  1  0  0  0  0
  9 29  1  0  0  0  0
 10 11  2  0  0  0  0
 10 30  1  0  0  0  0
 11 15  1  0  0  0  0
 11 22  1  0  0  0  0
 12 15  2  0  0  0  0
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 13 14  1  0  0  0  0
 13 32  1  0  0  0  0
 14 19  2  0  0  0  0
 15 33  1  0  0  0  0
 16 20  2  0  0  0  0
 16 34  1  0  0  0  0
 17 18  2  0  0  0  0
 17 21  1  0  0  0  0
 17 23  1  0  0  0  0
 18 24  1  0  0  0  0
 18 27  1  0  0  0  0
 19 20  1  0  0  0  0
 19 35  1  0  0  0  0
 20 37  1  0  0  0  0
 22 38  1  0  0  0  0
 22 39  1  0  0  0  0
 22 40  1  0  0  0  0
 23 26  2  0  0  0  0
 23 41  1  0  0  0  0
 24 25  2  0  0  0  0
 24 42  1  0  0  0  0
 25 26  1  0  0  0  0
 26 43  1  0  0  0  0
 27 44  1  0  0  0  0
 27 45  1  0  0  0  0
 27 46  1  0  0  0  0
 28 47  1  0  0  0  0
 28 48  1  0  0  0  0
 28 49  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
67968048

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
542

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
3

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
4

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceB7MAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAFgB9AAAHgAQAAAADAzBnwY/9p/MHACoAzd3dACCiC01MqAJ2CE+fNiMbvLEvZuUMShs1BPI6aeY3JLOoAABQAAQAABAAAKAACAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

> <PUBCHEM_IUPAC_CAS_NAME>
4-methoxy-2-methyl-N-[3-(7-methyl-2-imidazo[1,2-a]pyridinyl)phenyl]benzamide

> <PUBCHEM_IUPAC_NAME_MARKUP>
4-methoxy-2-methyl-<I>N</I>-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

> <PUBCHEM_IUPAC_NAME>
4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
4-methoxy-2-methyl-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C23H21N3O2/c1-15-9-10-26-14-21(25-22(26)11-15)17-5-4-6-18(13-17)24-23(27)20-8-7-19(28-3)12-16(20)2/h4-14H,1-3H3,(H,24,27)

> <PUBCHEM_IUPAC_INCHIKEY>
PIUNJWUVQCRHKJ-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
5

> <PUBCHEM_EXACT_MASS>
371.16337692

> <PUBCHEM_MOLECULAR_FORMULA>
C23H21N3O2

> <PUBCHEM_MOLECULAR_WEIGHT>
371.4

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1=CC2=NC(=CN2C=C1)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)OC)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1=CC2=NC(=CN2C=C1)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)OC)C

> <PUBCHEM_CACTVS_TPSA>
55.6

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
371.16337692

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
28

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
10  11  8
11  15  8
12  15  8
13  14  8
14  19  8
16  20  8
17  18  8
17  23  8
18  24  8
19  20  8
23  26  8
24  25  8
25  26  8
3  12  8
3  7  8
3  9  8
4  6  8
4  7  8
6  9  8
7  10  8
8  13  8
8  16  8

$$$$