
 AMG-7703

 34 35  0  0  0  0  0  0  0  0999 V2000
    0.3699   -4.1727    0.5592 C   0  0  0  0  0
   -0.0460   -2.7377    0.8997 C   0  0  0  0  0
   -1.4314   -2.7714    1.5645 C   0  0  0  0  0
    0.9632   -1.9022    1.7505 C   0  0  0  0  0
    1.2345   -2.4853    3.1386 C   0  0  0  0  0
    2.1402   -3.5384    3.3383 C   0  0  0  0  0
    2.4008   -4.0174    4.6256 C   0  0  0  0  0
    1.7635   -3.4441    5.7232 C   0  0  0  0  0
    0.8573   -2.4039    5.5459 C   0  0  0  0  0
    0.5895   -1.9335    4.2595 C   0  0  0  0  0
    2.1046   -4.0176    7.3091 Cl  0  0  0  0  0
    2.2790   -1.5798    1.0062 C   0  0  0  0  0
    2.6496   -2.2233    0.0169 O   0  0  0  0  0
    3.1340   -0.6169    1.4634 N   0  0  0  0  0
    2.8766    0.3349    2.4058 C   0  0  0  0  0
    1.7440    0.6627    2.9682 N   0  0  0  0  0
    1.9609    1.6765    3.8796 C   0  0  0  0  0
    3.2645    2.1119    3.9814 C   0  0  0  0  0
    4.2459    1.2433    2.8730 S   0  0  0  0  0
    1.3035   -4.2098   -0.0065 H   0  0  0  0  0
   -0.3954   -4.6462   -0.0675 H   0  0  0  0  0
    0.4818   -4.7934    1.4521 H   0  0  0  0  0
   -0.1662   -2.2102   -0.0571 H   0  0  0  0  0
   -1.4245   -3.3743    2.4789 H   0  0  0  0  0
   -2.1737   -3.2089    0.8882 H   0  0  0  0  0
   -1.7718   -1.7629    1.8213 H   0  0  0  0  0
    0.4609   -0.9346    1.8704 H   0  0  0  0  0
    2.6566   -3.9938    2.4950 H   0  0  0  0  0
    3.1062   -4.8324    4.7639 H   0  0  0  0  0
    0.3634   -1.9477    6.3991 H   0  0  0  0  0
   -0.1079   -1.1066    4.1357 H   0  0  0  0  0
    4.0366   -0.5888    1.0172 H   0  0  0  0  0
    1.1254    2.0625    4.4514 H   0  0  0  0  0
    3.6706    2.8779    4.6258 H   0  0  0  0  0
  1  2  1  0  0  0
  1 20  1  0  0  0
  1 21  1  0  0  0
  1 22  1  0  0  0
  2  4  1  0  0  0
  2  3  1  0  0  0
  2 23  1  0  0  0
  3 24  1  0  0  0
  3 25  1  0  0  0
  3 26  1  0  0  0
  4 12  1  0  0  0
  4  5  1  0  0  0
  4 27  1  0  0  0
  5  6  2  0  0  0
  5 10  1  0  0  0
  6  7  1  0  0  0
  6 28  1  0  0  0
  7  8  2  0  0  0
  7 29  1  0  0  0
  8  9  1  0  0  0
  8 11  1  0  0  0
  9 10  2  0  0  0
  9 30  1  0  0  0
 10 31  1  0  0  0
 12 14  1  0  0  0
 12 13  2  0  0  0
 14 15  1  0  0  0
 14 32  1  0  0  0
 15 16  2  0  0  0
 15 19  1  0  0  0
 16 17  1  0  0  0
 17 18  2  0  0  0
 17 33  1  0  0  0
 18 19  1  0  0  0
 18 34  1  0  0  0
M  END

>  <Chemical Name>
AMG-7703

>  <PubChem CID>
854189

>  <Formula>
C14H15ClN2OS

>  <Molecular Weight>
294.797000

>  <IUPAC Name>
(2S)-2-(4-chlorophenyl)-3-methyl-N-(1,3-thiazol-2-yl)butanamide

>  <XlogP>
4.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NC2=NC=CS2

>  <Isomeric SMILES>
CC(C)[C@@H](C1=CC=C(C=C1)Cl)C(=O)NC2=NC=CS2

>  <InChI Std. ID>
InChI=1S/C14H15ClN2OS/c1-9(2)12(10-3-5-11(15)6-4-10)13(18)17-14-16-7-8-19-14/h3-9,12H,1-2H3,(H,16,17,18)/t12-/m0/s1

>  <InChI Key>
AZYDQCGCBQYFSE-LBPRGKRZSA-N

