{
  "route": {
    "id": "cmisc0d9v02gca8ddsmfsvax2",
    "signature": "757fe08287ab3eb2a80951670700e4fbf919c7269ac3456debb21d05fec40006",
    "contentHash": "2cc8fd4d1a9a686c579eb240c44d51acbe2ec04553e6f24aea5e141a790720ed",
    "length": 4,
    "isConvergent": false
  },
  "target": {
    "id": "cmisc0d9u02g9a8ddcfv3eo4c",
    "benchmarkSetId": "cmisc0cnd0000a8dd4g4pdf0s",
    "targetId": "n5-00285",
    "moleculeId": "o5uwrv207mr7n2c0q7id5ep4",
    "routeLength": 6,
    "isConvergent": false,
    "metadata": "{}",
    "molecule": {
      "id": "o5uwrv207mr7n2c0q7id5ep4",
      "inchikey": "RDUISJDOWOIILY-UHFFFAOYSA-N",
      "smiles": "CC(C)(C)OC(=O)NC1(c2ccnc(Br)c2)CC1"
    },
    "hasAcceptableRoutes": true,
    "acceptableRoutesCount": 2
  },
  "rootNode": {
    "id": "cmisc0d9v02gda8ddxuhpvzgo",
    "routeId": "cmisc0d9v02gca8ddsmfsvax2",
    "moleculeId": "o5uwrv207mr7n2c0q7id5ep4",
    "parentId": null,
    "isLeaf": false,
    "reactionHash": null,
    "template": null,
    "metadata": "{\"ID\":\"US20120270870A1;0175;1289472\",\"rsmi\":\"O[C:6](=[O:7])[C:9]1([c:10]2[cH:11][c:12]([Br:13])[n:14][cH:15][cH:16]2)[CH2:17][CH2:18]1.[CH3:1][C:2]([CH3:3])([CH3:4])[OH:5].[N-]=[N+]=[N:8]P(=O)(c1ccccc1)c1ccccc1>CCN(CC)CC>[CH3:1][C:2]([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]1([c:10]2[cH:11][c:12]([Br:13])[n:14][cH:15][cH:16]2)[CH2:17][CH2:18]1\"}",
    "molecule": {
      "id": "o5uwrv207mr7n2c0q7id5ep4",
      "inchikey": "RDUISJDOWOIILY-UHFFFAOYSA-N",
      "smiles": "CC(C)(C)OC(=O)NC1(c2ccnc(Br)c2)CC1"
    },
    "children": [
      {
        "id": "cmisc0d9v02gea8ddaruo45wk",
        "routeId": "cmisc0d9v02gca8ddsmfsvax2",
        "moleculeId": "wfo3wxdzf1icttmx9k8so773",
        "parentId": "cmisc0d9v02gda8ddxuhpvzgo",
        "isLeaf": true,
        "reactionHash": null,
        "template": null,
        "metadata": null,
        "molecule": {
          "id": "wfo3wxdzf1icttmx9k8so773",
          "inchikey": "DKGAVHZHDRPRBM-UHFFFAOYSA-N",
          "smiles": "CC(C)(C)O"
        },
        "children": []
      },
      {
        "id": "cmisc0d9v02gfa8dd077i7a1t",
        "routeId": "cmisc0d9v02gca8ddsmfsvax2",
        "moleculeId": "qhe2d797ura4i531nudw4cvk",
        "parentId": "cmisc0d9v02gda8ddxuhpvzgo",
        "isLeaf": false,
        "reactionHash": null,
        "template": null,
        "metadata": "{\"ID\":\"US20120270870A1;0174;1289471\",\"rsmi\":\"CC(C)(C)[OH:3].[O:1]=[CH:2][C:4]1([c:5]2[cH:6][c:7]([Br:8])[n:9][cH:10][cH:11]2)[CH2:12][CH2:13]1>CC=C(C)C.O.O.O=P(O)(O)O.[Na+].[Na+].[O-][Cl+]O>[O:1]=[C:2]([OH:3])[C:4]1([c:5]2[cH:6][c:7]([Br:8])[n:9][cH:10][cH:11]2)[CH2:12][CH2:13]1\"}",
        "molecule": {
          "id": "qhe2d797ura4i531nudw4cvk",
          "inchikey": "IPHJRNBPNWSYIK-UHFFFAOYSA-N",
          "smiles": "O=C(O)C1(c2ccnc(Br)c2)CC1"
        },
        "children": [
          {
            "id": "cmisc0d9v02gha8ddvhwems86",
            "routeId": "cmisc0d9v02gca8ddsmfsvax2",
            "moleculeId": "wfo3wxdzf1icttmx9k8so773",
            "parentId": "cmisc0d9v02gfa8dd077i7a1t",
            "isLeaf": true,
            "reactionHash": null,
            "template": null,
            "metadata": null,
            "molecule": {
              "id": "wfo3wxdzf1icttmx9k8so773",
              "inchikey": "DKGAVHZHDRPRBM-UHFFFAOYSA-N",
              "smiles": "CC(C)(C)O"
            },
            "children": []
          },
          {
            "id": "cmisc0d9w02gia8ddsgs79pbn",
            "routeId": "cmisc0d9v02gca8ddsmfsvax2",
            "moleculeId": "vfdamxn1mb83m7h6150cuyiw",
            "parentId": "cmisc0d9v02gfa8dd077i7a1t",
            "isLeaf": false,
            "reactionHash": null,
            "template": null,
            "metadata": "{\"ID\":\"US20120270870A1;0173;1289470\",\"rsmi\":\"CCOC(C)=[O:1].N#[C:2][C:3]1([c:4]2[cH:5][c:6]([Br:7])[n:8][cH:9][cH:10]2)[CH2:11][CH2:12]1>CC(C)C[AlH]CC(C)C.Cc1ccccc1.O=S(=O)(O)O>[O:1]=[CH:2][C:3]1([c:4]2[cH:5][c:6]([Br:7])[n:8][cH:9][cH:10]2)[CH2:11][CH2:12]1\"}",
            "molecule": {
              "id": "vfdamxn1mb83m7h6150cuyiw",
              "inchikey": "WZFYOHARLCOXOL-UHFFFAOYSA-N",
              "smiles": "O=CC1(c2ccnc(Br)c2)CC1"
            },
            "children": [
              {
                "id": "cmisc0d9w02gja8ddu6sew4u3",
                "routeId": "cmisc0d9v02gca8ddsmfsvax2",
                "moleculeId": "x7oql1e1yu7emj8wavga59ni",
                "parentId": "cmisc0d9w02gia8ddsgs79pbn",
                "isLeaf": true,
                "reactionHash": null,
                "template": null,
                "metadata": null,
                "molecule": {
                  "id": "x7oql1e1yu7emj8wavga59ni",
                  "inchikey": "XEKOWRVHYACXOJ-UHFFFAOYSA-N",
                  "smiles": "CCOC(C)=O"
                },
                "children": []
              },
              {
                "id": "cmisc0d9w02gka8ddme3nq881",
                "routeId": "cmisc0d9v02gca8ddsmfsvax2",
                "moleculeId": "pqsq7ldvukbolgswg3ygdvmx",
                "parentId": "cmisc0d9w02gia8ddsgs79pbn",
                "isLeaf": false,
                "reactionHash": null,
                "template": null,
                "metadata": "{\"ID\":\"US20120270870A1;0172;1289469\",\"rsmi\":\"Br[CH2:11][CH2:12]Br.[N:1]#[C:2][CH2:3][c:4]1[cH:5][c:6]([Br:7])[n:8][cH:9][cH:10]1>CCOC(C)=O.CCOCC.CS(C)=O.O.[HH].[Na+]>[N:1]#[C:2][C:3]1([c:4]2[cH:5][c:6]([Br:7])[n:8][cH:9][cH:10]2)[CH2:11][CH2:12]1\"}",
                "molecule": {
                  "id": "pqsq7ldvukbolgswg3ygdvmx",
                  "inchikey": "HKLRZPZCPJJBTP-UHFFFAOYSA-N",
                  "smiles": "N#CC1(c2ccnc(Br)c2)CC1"
                },
                "children": [
                  {
                    "id": "cmisc0d9w02gla8ddqxt9t4tx",
                    "routeId": "cmisc0d9v02gca8ddsmfsvax2",
                    "moleculeId": "xt61gi8yircyk437zxud6zpu",
                    "parentId": "cmisc0d9w02gka8ddme3nq881",
                    "isLeaf": true,
                    "reactionHash": null,
                    "template": null,
                    "metadata": null,
                    "molecule": {
                      "id": "xt61gi8yircyk437zxud6zpu",
                      "inchikey": "PAAZPARNPHGIKF-UHFFFAOYSA-N",
                      "smiles": "BrCCBr"
                    },
                    "children": []
                  },
                  {
                    "id": "cmisc0d9w02gma8dd3jf8ugo2",
                    "routeId": "cmisc0d9v02gca8ddsmfsvax2",
                    "moleculeId": "r6lfd4s7jjbwkub61billezj",
                    "parentId": "cmisc0d9w02gka8ddme3nq881",
                    "isLeaf": true,
                    "reactionHash": null,
                    "template": null,
                    "metadata": null,
                    "molecule": {
                      "id": "r6lfd4s7jjbwkub61billezj",
                      "inchikey": "PBNYXTKBDQXJFM-UHFFFAOYSA-N",
                      "smiles": "N#CCc1ccnc(Br)c1"
                    },
                    "children": []
                  }
                ]
              }
            ]
          }
        ]
      },
      {
        "id": "cmisc0d9v02gga8dd77oj2ya0",
        "routeId": "cmisc0d9v02gca8ddsmfsvax2",
        "moleculeId": "u4lidylo469izlivzsn079o7",
        "parentId": "cmisc0d9v02gda8ddxuhpvzgo",
        "isLeaf": true,
        "reactionHash": null,
        "template": null,
        "metadata": null,
        "molecule": {
          "id": "u4lidylo469izlivzsn079o7",
          "inchikey": "MKRTXPORKIRPDG-UHFFFAOYSA-N",
          "smiles": "[N-]=[N+]=NP(=O)(c1ccccc1)c1ccccc1"
        },
        "children": []
      }
    ]
  }
}