
 2-((5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl)thio)-N-(5-methylisoxazol-3-yl)acetamide

 38 40  0  0  0  0  0  0  0  0999 V2000
    9.1831    0.1779    1.9039 C   0  0  0  0  0
    8.2632    1.3259    1.9609 C   0  0  0  0  0
    6.9094    1.4677    2.1370 C   0  0  0  0  0
    6.6775    2.8622    2.0475 C   0  0  0  0  0
    7.8278    3.5139    1.8619 N   0  0  0  0  0
    8.8176    2.5543    1.7987 O   0  0  0  0  0
    5.4249    3.4286    2.1385 N   0  0  0  0  0
    5.0442    4.7329    2.0091 C   0  0  0  0  0
    3.8376    4.9836    2.1124 O   0  0  0  0  0
    6.0415    5.8430    1.7579 C   0  0  0  0  0
    6.4554    5.9194   -0.0127 S   0  0  0  0  0
    8.0337    6.6154    0.1560 C   0  0  0  0  0
    8.2843    7.7236    0.8227 N   0  0  0  0  0
    9.6556    7.8725    0.8330 N   0  0  0  0  0
   10.1458    6.8420    0.1729 C   0  0  0  0  0
    9.1684    6.0165   -0.3145 O   0  0  0  0  0
   11.5310    6.4496   -0.0470 C   0  0  0  0  0
   12.5589    7.1643    0.5834 C   0  0  0  0  0
   13.8953    6.7912    0.4135 C   0  0  0  0  0
   14.2323    5.7122   -0.4035 C   0  0  0  0  0
   13.2192    4.9890   -1.0309 C   0  0  0  0  0
   11.8778    5.3555   -0.8527 C   0  0  0  0  0
   15.5703    5.4464   -0.4834 O   0  0  0  0  0
   15.9915    4.6910   -1.6126 C   0  0  0  0  0
    8.6693   -0.7513    2.1698 H   0  0  0  0  0
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    9.5898    0.0648    0.8936 H   0  0  0  0  0
    6.1912    0.6769    2.2872 H   0  0  0  0  0
    4.6488    2.7989    2.2898 H   0  0  0  0  0
    6.9136    5.7258    2.4063 H   0  0  0  0  0
    5.5745    6.7921    2.0425 H   0  0  0  0  0
   12.3256    8.0142    1.2233 H   0  0  0  0  0
   14.6787    7.3524    0.9192 H   0  0  0  0  0
   13.4363    4.1250   -1.6497 H   0  0  0  0  0
   11.1062    4.7678   -1.3466 H   0  0  0  0  0
   17.0864    4.6799   -1.6168 H   0  0  0  0  0
   15.6578    5.1570   -2.5474 H   0  0  0  0  0
   15.6504    3.6520   -1.5455 H   0  0  0  0  0
  1  2  1  0  0  0
  1 25  1  0  0  0
  1 26  1  0  0  0
  1 27  1  0  0  0
  2  3  2  0  0  0
  2  6  1  0  0  0
  3  4  1  0  0  0
  3 28  1  0  0  0
  4  5  2  0  0  0
  4  7  1  0  0  0
  5  6  1  0  0  0
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  8  9  2  0  0  0
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M  END

>  <Chemical Name>
2-((5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl)thio)-N-(5-methylisoxazol-3-yl)acetamide

>  <PubChem CID>
2085595

>  <Formula>
C15H14N4O4S

>  <Molecular Weight>
346.361000

>  <IUPAC Name>
2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

>  <XlogP>
2.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CC1=CC(=NO1)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)OC

>  <Isomeric SMILES>
CC1=CC(=NO1)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)OC

>  <InChI Std. ID>
InChI=1S/C15H14N4O4S/c1-9-7-12(19-23-9)16-13(20)8-24-15-18-17-14(22-15)10-3-5-11(21-2)6-4-10/h3-7H,8H2,1-2H3,(H,16,19,20)

>  <InChI Key>
ACBCSQZMSDTKRD-UHFFFAOYSA-N

