Chloride → HCID 10186317, compound
Reaction equation
[Br:22][c:23]1[cH:24][cH:25][c:26]2[c:27]([NH:35][c:36]3[c:37]([Cl:45])[cH:38][c:39]([Cl:44])[c:40]([O:42][CH3:43])[cH:41]3)[c:28]([C:33]#[N:34])[cH:29][n:30][c:31]2[cH:32]1.[CH2:48]1[O:49][CH2:50][CH2:51][O:52][CH2:53]1.[Cl-:47].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[cH:8][n:9][c:10]([CH2:13][N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[cH:11][cH:12]1)(=[O:20])=[O:21].[Li+:46].[cH:54]1[cH:55][cH:56][c:57]([P:58]([Pd:59]([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[P:98]([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)([c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)[cH:129][cH:130]1>>[c:7]1(-[c:23]2[cH:24][cH:25][c:26]3[c:27]([NH:35][c:36]4[c:37]([Cl:45])[cH:38][c:39]([Cl:44])[c:40]([O:42][CH3:43])[cH:41]4)[c:28]([C:33]#[N:34])[cH:29][n:30][c:31]3[cH:32]2)[cH:8][n:9][c:10]([CH2:13][N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[cH:11][cH:12]1Participants
7
Sources & evidence
- ORD record
- ord-9446c058d56344ed9cf6fb3752c8d270
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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