{
  "route": {
    "id": "cmisc0a5t010p7qddvz4pie19",
    "signature": "6d33f1156583d752a21591f9670c29e6bc204d84a447256ce020023fdd20b5a6",
    "contentHash": "2fd258f91c42d04f620ff96b043f6bfe0f187c0f51025bb6b26568d20fe1c72e",
    "length": 3,
    "isConvergent": false
  },
  "target": {
    "id": "cmisc0a5t010o7qddg8znem8s",
    "benchmarkSetId": "cmisc09u000007qddhq6eczgb",
    "targetId": "n5-05196",
    "moleculeId": "lwdme96fpoqmfxk3byww1zr0",
    "routeLength": 3,
    "isConvergent": false,
    "metadata": "{}",
    "molecule": {
      "id": "lwdme96fpoqmfxk3byww1zr0",
      "inchikey": "TWNJPOVZLPPMMG-UHFFFAOYSA-N",
      "smiles": "Brc1ccc(-c2cnc3nnc(Cc4c[nH]c5ccccc45)n3n2)cc1"
    },
    "hasAcceptableRoutes": true,
    "acceptableRoutesCount": 1
  },
  "rootNode": {
    "id": "cmisc0a5t010q7qddvednxwgl",
    "routeId": "cmisc0a5t010p7qddvz4pie19",
    "moleculeId": "lwdme96fpoqmfxk3byww1zr0",
    "parentId": null,
    "isLeaf": false,
    "reactionHash": null,
    "template": null,
    "metadata": "{\"ID\":\"US20130324542A1;0192;1457111\",\"rsmi\":\"O=[C:9]([CH2:10][c:11]1[cH:12][nH:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]12)[NH:20][NH:21][c:22]1[n:8][n:7][c:6](-[c:5]2[cH:4][cH:3][c:2]([Br:1])[cH:26][cH:25]2)[cH:24][n:23]1>O=C(Cc1ccc2ncccc2c1)NNc1ncc(-c2ccccc2)nn1>[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:6]2[n:7][n:8]3[c:9]([CH2:10][c:11]4[cH:12][nH:13][c:14]5[cH:15][cH:16][cH:17][cH:18][c:19]45)[n:20][n:21][c:22]3[n:23][cH:24]2)[cH:25][cH:26]1\"}",
    "molecule": {
      "id": "lwdme96fpoqmfxk3byww1zr0",
      "inchikey": "TWNJPOVZLPPMMG-UHFFFAOYSA-N",
      "smiles": "Brc1ccc(-c2cnc3nnc(Cc4c[nH]c5ccccc45)n3n2)cc1"
    },
    "children": [
      {
        "id": "cmisc0a5u010r7qdda1kn47a8",
        "routeId": "cmisc0a5t010p7qddvz4pie19",
        "moleculeId": "n8p3zvy1qj7maas7qk7rqk55",
        "parentId": "cmisc0a5t010q7qddvednxwgl",
        "isLeaf": false,
        "reactionHash": null,
        "template": null,
        "metadata": "{\"ID\":\"US20130324542A1;0190;1457110\",\"rsmi\":\"O[C:2](=[O:1])[CH2:3][c:4]1[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12.[NH2:13][NH:14][c:15]1[n:16][cH:17][c:18](-[c:19]2[cH:20][cH:21][c:22]([Br:23])[cH:24][cH:25]2)[n:26][n:27]1>NNc1ncc(-c2ccccc2)nn1.O=C(O)Cc1ccc2ncccc2c1>[O:1]=[C:2]([CH2:3][c:4]1[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12)[NH:13][NH:14][c:15]1[n:16][cH:17][c:18](-[c:19]2[cH:20][cH:21][c:22]([Br:23])[cH:24][cH:25]2)[n:26][n:27]1\"}",
        "molecule": {
          "id": "n8p3zvy1qj7maas7qk7rqk55",
          "inchikey": "FMFLRPSPHCJRMT-UHFFFAOYSA-N",
          "smiles": "O=C(Cc1c[nH]c2ccccc12)NNc1ncc(-c2ccc(Br)cc2)nn1"
        },
        "children": [
          {
            "id": "cmisc0a5u010s7qddc98j0no8",
            "routeId": "cmisc0a5t010p7qddvz4pie19",
            "moleculeId": "aeuwhkwlh7i83awli2rt17hp",
            "parentId": "cmisc0a5u010r7qdda1kn47a8",
            "isLeaf": false,
            "reactionHash": null,
            "template": null,
            "metadata": "{\"ID\":\"US20130324542A1;0188;1457109\",\"rsmi\":\"CS(=O)[c:3]1[n:4][cH:5][c:6](-[c:7]2[cH:8][cH:9][c:10]([Br:11])[cH:12][cH:13]2)[n:14][n:15]1.CS(=O)c1ncc(-c2ccccc2)[n:1][n:2]1>>[NH2:1][NH:2][c:3]1[n:4][cH:5][c:6](-[c:7]2[cH:8][cH:9][c:10]([Br:11])[cH:12][cH:13]2)[n:14][n:15]1\"}",
            "molecule": {
              "id": "aeuwhkwlh7i83awli2rt17hp",
              "inchikey": "CCSMKMZSEWCEFO-UHFFFAOYSA-N",
              "smiles": "NNc1ncc(-c2ccc(Br)cc2)nn1"
            },
            "children": [
              {
                "id": "cmisc0a5u010u7qddz8qjcg7r",
                "routeId": "cmisc0a5t010p7qddvz4pie19",
                "moleculeId": "f7r8k6wfa3wma1e4kv143guk",
                "parentId": "cmisc0a5u010s7qddc98j0no8",
                "isLeaf": true,
                "reactionHash": null,
                "template": null,
                "metadata": null,
                "molecule": {
                  "id": "f7r8k6wfa3wma1e4kv143guk",
                  "inchikey": "YZBSXCKXUYYPQL-UHFFFAOYSA-N",
                  "smiles": "CS(=O)c1ncc(-c2ccc(Br)cc2)nn1"
                },
                "children": []
              },
              {
                "id": "cmisc0a5u010v7qdd8ktwbx1o",
                "routeId": "cmisc0a5t010p7qddvz4pie19",
                "moleculeId": "szn6cg6o3umcuw5di4hows6s",
                "parentId": "cmisc0a5u010s7qddc98j0no8",
                "isLeaf": true,
                "reactionHash": null,
                "template": null,
                "metadata": null,
                "molecule": {
                  "id": "szn6cg6o3umcuw5di4hows6s",
                  "inchikey": "ZPLKMHMFRUZCFM-UHFFFAOYSA-N",
                  "smiles": "CS(=O)c1ncc(-c2ccccc2)nn1"
                },
                "children": []
              }
            ]
          },
          {
            "id": "cmisc0a5u010t7qdd5f0gc1q4",
            "routeId": "cmisc0a5t010p7qddvz4pie19",
            "moleculeId": "k37w14rx0kypqcy18fsh9gaw",
            "parentId": "cmisc0a5u010r7qdda1kn47a8",
            "isLeaf": true,
            "reactionHash": null,
            "template": null,
            "metadata": null,
            "molecule": {
              "id": "k37w14rx0kypqcy18fsh9gaw",
              "inchikey": "SEOVTRFCIGRIMH-UHFFFAOYSA-N",
              "smiles": "O=C(O)Cc1c[nH]c2ccccc12"
            },
            "children": []
          }
        ]
      }
    ]
  }
}