Ethyl 2-(2-aminothiazol-5-ylthio)acetate → HCID 57668341, compound
Reaction equation
[C:65]([CH:66]1[CH2:67][CH2:68][CH:69]([CH2:70][NH:71][c:72]2[cH:73][cH:74][c:75]([F:76])[c:77]([F:78])[cH:79]2)[CH2:80][CH2:81]1)([CH3:82])([CH3:83])[CH3:84].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][S:6][c:7]1[cH:8][n:9][c:10]([NH:12][C:13](=[O:14])[N:15]([CH2:16][CH:17]2[CH2:18][CH2:19][CH:20]([C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:21][CH2:22]2)[c:27]2[cH:28][c:29]([F:34])[c:30]([F:33])[cH:31][cH:32]2)[s:11]1)=[O:35].[CH2:85]([O:86][C:87](=[O:88])[CH2:89][S:90][c:91]1[s:92][c:93]([NH2:94])[n:95][cH:96]1)[CH3:97].[CH:36]1([CH2:37][N:38]([c:39]2[cH:40][cH:41][c:42]([S:43]([CH3:44])(=[O:45])=[O:46])[cH:47][cH:48]2)[C:49](=[O:50])[NH:51][c:52]2[s:53][cH:54][c:55]([CH2:56][C:57]([OH:58])=[O:59])[n:60]2)[CH2:61][CH2:62][CH2:63][CH2:64]1>>[O:3]=[C:4]([CH2:5][S:6][c:7]1[cH:8][n:9][c:10]([NH:12][C:13](=[O:14])[N:15]([CH2:16][CH:17]2[CH2:18][CH2:19][CH:20]([C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:21][CH2:22]2)[c:27]2[cH:28][c:29]([F:34])[c:30]([F:33])[cH:31][cH:32]2)[s:11]1)[OH:35]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-85474b00c13847fba3aa2d8bd7d35d3e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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