
 SCHEMBL9697598

 32 34  0  0  0  0  0  0  0  0999 V2000
    2.1241    0.1885    2.2720 C   0  0  0  0  0
    2.5074    1.2194    1.5071 C   0  0  0  0  0
    2.9925    1.1061    0.0876 C   0  0  0  0  0
    4.4492    1.0089    0.0118 N   0  0  0  0  0
    5.1266   -0.2064   -0.0169 C   0  0  0  0  0
    4.6613   -1.5324   -0.0045 C   0  0  0  0  0
    5.5992   -2.5684   -0.0211 C   0  0  0  0  0
    6.9623   -2.2948   -0.0536 C   0  0  0  0  0
    7.4196   -0.9731   -0.0773 C   0  0  0  0  0
    6.4890    0.0844   -0.0602 C   0  0  0  0  0
    6.6117    1.4951   -0.0835 C   0  0  0  0  0
    5.3475    2.0676   -0.0383 C   0  0  0  0  0
    5.0550    3.4868   -0.0517 C   0  0  0  0  0
    3.8204    3.9205   -0.0042 N   0  0  0  0  0
    3.9248    5.4028   -0.0539 C   0  0  0  0  0
    5.3912    5.7341    0.2082 C   0  0  0  0  0
    6.0149    4.4714   -0.0926 N   0  0  0  0  0
    1.7845    0.3473    3.2904 H   0  0  0  0  0
    2.1663   -0.8357    1.9133 H   0  0  0  0  0
    2.4613    2.2287    1.9101 H   0  0  0  0  0
    2.6493    1.9423   -0.5254 H   0  0  0  0  0
    2.5716    0.2162   -0.3965 H   0  0  0  0  0
    3.6014   -1.7641    0.0207 H   0  0  0  0  0
    5.2562   -3.5995   -0.0068 H   0  0  0  0  0
    7.6778   -3.1127   -0.0619 H   0  0  0  0  0
    8.4849   -0.7673   -0.1066 H   0  0  0  0  0
    7.5437    2.0410   -0.1356 H   0  0  0  0  0
    3.6111    5.7471   -1.0462 H   0  0  0  0  0
    3.2722    5.8601    0.6954 H   0  0  0  0  0
    5.5522    5.9977    1.2586 H   0  0  0  0  0
    5.7573    6.5425   -0.4300 H   0  0  0  0  0
    6.8898    4.2605    0.3704 H   0  0  0  0  0
  1  2  2  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  2  3  1  0  0  0
  2 20  1  0  0  0
  3  4  1  0  0  0
  3 21  1  0  0  0
  3 22  1  0  0  0
  4  5  1  0  0  0
  4 12  1  0  0  0
  5  6  2  0  0  0
  5 10  1  0  0  0
  6  7  1  0  0  0
  6 23  1  0  0  0
  7  8  2  0  0  0
  7 24  1  0  0  0
  8  9  1  0  0  0
  8 25  1  0  0  0
  9 10  2  0  0  0
  9 26  1  0  0  0
 10 11  1  0  0  0
 11 12  2  0  0  0
 11 27  1  0  0  0
 12 13  1  0  0  0
 13 14  2  0  0  0
 13 17  1  0  0  0
 14 15  1  0  0  0
 15 16  1  0  0  0
 15 28  1  0  0  0
 15 29  1  0  0  0
 16 17  1  0  0  0
 16 30  1  0  0  0
 16 31  1  0  0  0
 17 32  1  0  0  0
M  END

>  <Chemical Name>
SCHEMBL9697598

>  <PubChem CID>
53741044

>  <Formula>
C14H15N3

>  <Molecular Weight>
225.295000

>  <IUPAC Name>
2-(4,5-dihydro-1H-imidazol-2-yl)-1-prop-2-enylindole

>  <XlogP>
2.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
C=CCN1C2=CC=CC=C2C=C1C3=NCCN3

>  <Isomeric SMILES>
C=CCN1C2=CC=CC=C2C=C1C3=NCCN3

>  <InChI Std. ID>
InChI=1S/C14H15N3/c1-2-9-17-12-6-4-3-5-11(12)10-13(17)14-15-7-8-16-14/h2-6,10H,1,7-9H2,(H,15,16)

>  <InChI Key>
CUOQKQBYZYMBSP-UHFFFAOYSA-N

