Dichloromethane → HCID 22500111, compound
Reaction equation
[CH2:45]([N:46]([CH2:47][CH3:48])[CH2:49][CH3:50])[CH3:51].[CH3:63][N:64]([CH3:65])[c:66]1[cH:67][cH:68][n:69][cH:70][cH:71]1.[Cl:72][CH2:73][Cl:74].[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([S:10](=[O:11])(=[O:12])[N:13]([CH2:14][CH:15]([CH:16]([CH2:17][c:18]1[cH:19][cH:20][c:21]([O:24][CH2:25][CH2:26][OH:27])[cH:22][cH:23]1)[NH:28][C:29]([O:30][CH:31]1[CH2:32][O:33][CH:34]3[O:35][CH2:36][CH2:37][CH:38]13)=[O:39])[OH:40])[CH2:41][CH:42]([CH3:43])[CH3:44])[cH:9]2.[c:52]1([CH3:62])[cH:53][cH:54][c:55]([S:58](=[O:59])(=[O:60])[Cl:61])[cH:56][cH:57]1>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([S:10](=[O:11])(=[O:12])[N:13]([CH2:14][CH:15]([CH:16]([CH2:17][c:18]1[cH:19][cH:20][c:21]([O:24][CH2:25][CH2:26][O:27][S:58]([c:55]3[cH:54][cH:53][c:52]([CH3:62])[cH:57][cH:56]3)(=[O:59])=[O:60])[cH:22][cH:23]1)[NH:28][C:29]([O:30][CH:31]1[CH2:32][O:33][CH:34]3[O:35][CH2:36][CH2:37][CH:38]13)=[O:39])[OH:40])[CH2:41][CH:42]([CH3:43])[CH3:44])[cH:9]2Participants
6
Sources & evidence
- ORD record
- ord-c1ac0e5c5e0f44df9eb02b1f5a990038
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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