{
  "route": {
    "id": "cmisbzzys015k19ddgemfq9xo",
    "signature": "49c6565851130ad8b2ec89bd4e7b289081fb2493158b184fb04a5dd3d98789c9",
    "contentHash": "bf55d36cd03d77c604e153050a3455d611cdbef16fe928640974f53944979f7e",
    "length": 3,
    "isConvergent": false
  },
  "target": {
    "id": "cmisc0cvw00q9a8ddzlj1p1u9",
    "benchmarkSetId": "cmisc0cnd0000a8dd4g4pdf0s",
    "targetId": "n5-05941",
    "moleculeId": "v4hkfkvxlv5sm3st6wcdkv5r",
    "routeLength": 3,
    "isConvergent": false,
    "metadata": "{}",
    "molecule": {
      "id": "v4hkfkvxlv5sm3st6wcdkv5r",
      "inchikey": "XIQBJLMZHSLEHM-UHFFFAOYSA-N",
      "smiles": "CCCC(=O)Nc1ccc(Cl)nc1C#CC(C)(C)C"
    },
    "hasAcceptableRoutes": true,
    "acceptableRoutesCount": 2
  },
  "rootNode": {
    "id": "cmisbzzys015l19ddc19ncjet",
    "routeId": "cmisbzzys015k19ddgemfq9xo",
    "moleculeId": "v4hkfkvxlv5sm3st6wcdkv5r",
    "parentId": null,
    "isLeaf": false,
    "reactionHash": null,
    "template": null,
    "metadata": "{\"ID\":\"US20150336956A1;0234;1791020\",\"rsmi\":\"Cl[C:4]([CH2:3][CH2:2][CH3:1])=[O:5].[NH2:6][c:7]1[cH:8][cH:9][c:10]([Cl:11])[n:12][c:13]1[C:14]#[C:15][C:16]([CH3:17])([CH3:18])[CH3:19]>ClCCl.O.c1ccncc1>[CH3:1][CH2:2][CH2:3][C:4](=[O:5])[NH:6][c:7]1[cH:8][cH:9][c:10]([Cl:11])[n:12][c:13]1[C:14]#[C:15][C:16]([CH3:17])([CH3:18])[CH3:19]\"}",
    "molecule": {
      "id": "v4hkfkvxlv5sm3st6wcdkv5r",
      "inchikey": "XIQBJLMZHSLEHM-UHFFFAOYSA-N",
      "smiles": "CCCC(=O)Nc1ccc(Cl)nc1C#CC(C)(C)C"
    },
    "children": [
      {
        "id": "cmisbzzys015m19ddqp12ejis",
        "routeId": "cmisbzzys015k19ddgemfq9xo",
        "moleculeId": "emnlzts3sjc3173hpex8nwpe",
        "parentId": "cmisbzzys015l19ddc19ncjet",
        "isLeaf": false,
        "reactionHash": null,
        "template": null,
        "metadata": "{\"ID\":\"US20150336956A1;0232;1791019\",\"rsmi\":\"I[c:7]1[n:8][c:9]([Cl:10])[cH:11][cH:12][c:13]1[NH2:14].[CH3:1][C:2]([CH3:3])([CH3:4])[C:5]#[CH:6]>CCN(CC)CC.Cc1ccccc1.Cl[Pd](Cl)([PH](c1ccccc1)(c1ccccc1)c1ccccc1)[PH](c1ccccc1)(c1ccccc1)c1ccccc1.N#N.O.[Cu]I>[CH3:1][C:2]([CH3:3])([CH3:4])[C:5]#[C:6][c:7]1[n:8][c:9]([Cl:10])[cH:11][cH:12][c:13]1[NH2:14]\"}",
        "molecule": {
          "id": "emnlzts3sjc3173hpex8nwpe",
          "inchikey": "XXSQAOVPCYJCTA-UHFFFAOYSA-N",
          "smiles": "CC(C)(C)C#Cc1nc(Cl)ccc1N"
        },
        "children": [
          {
            "id": "cmisbzzys015o19ddz6pnn8bi",
            "routeId": "cmisbzzys015k19ddgemfq9xo",
            "moleculeId": "ymy6l498z48oadrgb4ozknus",
            "parentId": "cmisbzzys015m19ddqp12ejis",
            "isLeaf": true,
            "reactionHash": null,
            "template": null,
            "metadata": null,
            "molecule": {
              "id": "ymy6l498z48oadrgb4ozknus",
              "inchikey": "PPWNCLVNXGCGAF-UHFFFAOYSA-N",
              "smiles": "C#CC(C)(C)C"
            },
            "children": []
          },
          {
            "id": "cmisbzzys015p19dd6fqepv0g",
            "routeId": "cmisbzzys015k19ddgemfq9xo",
            "moleculeId": "pc5hfzhxzou9fyg7qthsqt36",
            "parentId": "cmisbzzys015m19ddqp12ejis",
            "isLeaf": false,
            "reactionHash": null,
            "template": null,
            "metadata": "{\"ID\":\"US20150336956A1;0230;1791018\",\"rsmi\":\"I[I:9].[NH2:1][c:2]1[cH:3][cH:4][c:5]([Cl:6])[n:7][cH:8]1>CCO.O=S(=O)(O)O.[Ag+].[Ag+]>[NH2:1][c:2]1[cH:3][cH:4][c:5]([Cl:6])[n:7][c:8]1[I:9]\"}",
            "molecule": {
              "id": "pc5hfzhxzou9fyg7qthsqt36",
              "inchikey": "CWPAZQRTFHRMQI-UHFFFAOYSA-N",
              "smiles": "Nc1ccc(Cl)nc1I"
            },
            "children": [
              {
                "id": "cmisbzzyt015q19dd5hlort56",
                "routeId": "cmisbzzys015k19ddgemfq9xo",
                "moleculeId": "jgr163woggqzrdt1u6h8sx60",
                "parentId": "cmisbzzys015p19dd6fqepv0g",
                "isLeaf": true,
                "reactionHash": null,
                "template": null,
                "metadata": null,
                "molecule": {
                  "id": "jgr163woggqzrdt1u6h8sx60",
                  "inchikey": "PNDPGZBMCMUPRI-UHFFFAOYSA-N",
                  "smiles": "II"
                },
                "children": []
              },
              {
                "id": "cmisbzzyt015r19ddcq2860o8",
                "routeId": "cmisbzzys015k19ddgemfq9xo",
                "moleculeId": "s5ta3tze12xpjxqhi6ngddvb",
                "parentId": "cmisbzzys015p19dd6fqepv0g",
                "isLeaf": true,
                "reactionHash": null,
                "template": null,
                "metadata": null,
                "molecule": {
                  "id": "s5ta3tze12xpjxqhi6ngddvb",
                  "inchikey": "QAJYCQZQLVENRZ-UHFFFAOYSA-N",
                  "smiles": "Nc1ccc(Cl)nc1"
                },
                "children": []
              }
            ]
          }
        ]
      },
      {
        "id": "cmisbzzys015n19dd5dyhh4bu",
        "routeId": "cmisbzzys015k19ddgemfq9xo",
        "moleculeId": "o9s2qi7lp2wjwvv81n2jbvzl",
        "parentId": "cmisbzzys015l19ddc19ncjet",
        "isLeaf": true,
        "reactionHash": null,
        "template": null,
        "metadata": null,
        "molecule": {
          "id": "o9s2qi7lp2wjwvv81n2jbvzl",
          "inchikey": "DVECBJCOGJRVPX-UHFFFAOYSA-N",
          "smiles": "CCCC(=O)Cl"
        },
        "children": []
      }
    ]
  }
}