Carbamate → HCID 19004145, compound
Reaction equation
[CH3:50][O:51][c:52]1[c:53]([CH2:54][Cl:55])[cH:56][cH:57][cH:58][cH:59]1.[CH3:69][C:70]#[N:71].[CH:60]([N:61]([CH2:62][CH3:63])[CH:64]([CH3:65])[CH3:66])([CH3:67])[CH3:68].[CH:72]([Cl:73])([Cl:74])[Cl:75].[Cl:1][c:2]1[cH:3][c:4]([N:8]([C:9](=[O:10])[N:11]2[CH:12]([C:30](=[O:31])[NH:32][CH2:33][CH2:34][NH:35][CH2:36][C:37]([NH2:38])=[O:39])[CH2:13][N:14]([C:17]([N:18]([CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])=[O:29])[CH2:15][CH2:16]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:5][cH:6][cH:7]1.[NH2:46][C:47](=[O:48])[O-:49]>>[Cl:1][c:2]1[cH:3][c:4]([N:8]([C:9](=[O:10])[N:11]2[CH:12]([C:30](=[O:31])[NH:32][CH2:33][CH2:34][N:35]([CH2:36][C:37]([NH2:38])=[O:39])[CH2:54][c:53]3[c:52]([O:51][CH3:50])[cH:59][cH:58][cH:57][cH:56]3)[CH2:13][N:14]([C:17]([N:18]([CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])=[O:29])[CH2:15][CH2:16]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:5][cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-a90a784239a846aa94f3dcc3daed2641
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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