51224009
  -OEChem-05132400312D

 38 39  0     1  0  0  0  0  0999 V2000
    2.8660   -5.3533    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.6750   -0.7655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7336    3.7352    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5471    1.9081    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    4.3159    4.4397    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660    0.1856    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0570   -0.7655    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1349    2.7172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9538    0.9946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7281    3.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3660    0.1856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5526    2.0127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.3533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.3533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9092    5.3533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3104    4.3352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -2.8533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.8533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -3.8533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.8533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -4.3533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5656    2.2712    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6489    3.0639    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3845    0.5486    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4678    1.3413    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6174    2.6293    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9360    2.0775    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4877    1.3961    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4756    5.6054    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6570    5.9197    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3428    5.1011    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2456    3.7186    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9270    4.2704    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3752    4.9518    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -2.5433    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631   -2.5433    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -4.1633    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631   -4.1633    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 21  1  0  0  0  0
  2 11  1  0  0  0  0
  2 13  1  0  0  0  0
  3 10  2  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  4 12  1  0  0  0  0
  5 10  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  2  0  0  0  0
  7 13  2  0  0  0  0
  8 10  1  0  0  0  0
  8 22  1  0  0  0  0
  8 23  1  0  0  0  0
  9 11  1  0  0  0  0
  9 24  1  0  0  0  0
  9 25  1  0  0  0  0
 12 26  1  0  0  0  0
 12 27  1  0  0  0  0
 12 28  1  0  0  0  0
 13 14  1  0  0  0  0
 14 17  2  0  0  0  0
 14 18  1  0  0  0  0
 15 29  1  0  0  0  0
 15 30  1  0  0  0  0
 15 31  1  0  0  0  0
 16 32  1  0  0  0  0
 16 33  1  0  0  0  0
 16 34  1  0  0  0  0
 17 19  1  0  0  0  0
 17 35  1  0  0  0  0
 18 20  2  0  0  0  0
 18 36  1  0  0  0  0
 19 21  2  0  0  0  0
 19 37  1  0  0  0  0
 20 21  1  0  0  0  0
 20 38  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
51224009

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
348

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
5

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
5

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBzsAAEAAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAAABwAAAHgIIAAAADALBmiQyAIMABECqAiFyEACSAAAsBQAaiCG4DtgKZrKBtzmbMQBkygGYqYeYyCCOBAAAAAAAAAAIAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methyl-amino]-N,N-dimethyl-acetamide

> <PUBCHEM_IUPAC_CAS_NAME>
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]-N,N-dimethylacetamide

> <PUBCHEM_IUPAC_NAME_MARKUP>
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]-<I>N</I>,<I>N</I>-dimethylacetamide

> <PUBCHEM_IUPAC_NAME>
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]-N,N-dimethylacetamide

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methyl-amino]-N,N-dimethyl-ethanamide

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methyl-amino]-N,N-dimethyl-acetamide

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C14H17ClN4O2/c1-18(2)13(20)9-19(3)8-12-16-17-14(21-12)10-4-6-11(15)7-5-10/h4-7H,8-9H2,1-3H3

> <PUBCHEM_IUPAC_INCHIKEY>
INPLJQCBGWTKEO-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
1.4

> <PUBCHEM_EXACT_MASS>
308.1040035

> <PUBCHEM_MOLECULAR_FORMULA>
C14H17ClN4O2

> <PUBCHEM_MOLECULAR_WEIGHT>
308.76

> <PUBCHEM_OPENEYE_CAN_SMILES>
CN(C)C(=O)CN(C)CC1=NN=C(O1)C2=CC=C(C=C2)Cl

> <PUBCHEM_OPENEYE_ISO_SMILES>
CN(C)C(=O)CN(C)CC1=NN=C(O1)C2=CC=C(C=C2)Cl

> <PUBCHEM_CACTVS_TPSA>
62.5

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
308.1040035

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
21

> <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>
14  17  8
14  18  8
17  19  8
18  20  8
19  21  8
2  11  8
2  13  8
20  21  8
6  11  8
6  7  8
7  13  8

$$$$