Chloride → HCID 178464029, compound
Reaction equation
[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:13](=[O:14])[OH:15])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12]1.[Cl-:16].[Cl:17][c:18]1[cH:19][c:20]([CH:25]([CH2:26][NH:27][CH2:28][CH3:29])[CH2:30][CH2:31][N:32]2[CH2:33][CH2:34][CH:35]([c:38]3[c:39]([S:44](=[O:45])[CH3:46])[cH:40][cH:41][cH:42][cH:43]3)[CH2:36][CH2:37]2)[cH:21][cH:22][c:23]1[Cl:24].[Cl:47][c:48]1[cH:49][c:50]([CH:51]([CH2:52][CH2:53][N:54]2[CH2:55][CH2:56][CH:57]([c:58]3[cH:59][cH:60][cH:61][cH:62][c:63]3[S:64]([CH3:65])=[O:66])[CH2:67][CH2:68]2)[CH2:69][NH:70][CH3:71])[cH:72][cH:73][c:74]1[Cl:75].[Cl:76][C:77]([O:78][CH2:79][CH3:80])=[O:81]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:13](=[O:15])[N:27]([CH2:26][CH:25]([c:20]2[cH:19][c:18]([Cl:17])[c:23]([Cl:24])[cH:22][cH:21]2)[CH2:30][CH2:31][N:32]2[CH2:33][CH2:34][CH:35]([c:38]3[c:39]([S:44](=[O:45])[CH3:46])[cH:40][cH:41][cH:42][cH:43]3)[CH2:36][CH2:37]2)[CH2:28][CH3:29])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12]1Participants
6
Sources & evidence
- ORD record
- ord-d4a9f6802c7c4aa3ad81e8e25a80e7bb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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