Dichloromethane → HCID 59303546, compound
Reaction equation
[CH2:36]([c:38]1[cH:39][cH:40][cH:41][cH:42][cH:48]1)[S:43][CH:44]([CH2:45][NH:46][C:47](=[O:37])[c:49]1[nH:50][c:51]2[c:52]([N:66]([S:67](=[O:68])(=[O:69])[c:70]3[n:71][cH:72][cH:73][cH:74][cH:75]3)[CH3:76])[cH:53][c:54]([O:58][CH2:59][CH2:60][CH2:61][S:62](=[O:63])(=[O:64])[CH3:65])[cH:55][c:56]2[cH:57]1)[CH:77]([O:78][CH3:79])[O:80][CH3:81].[CH3:93][CH2:94][O:95][C:96](=[O:97])[CH3:98].[Cl:90][CH2:91][Cl:92].[F:21][C:22]([S:23]([O:24][S:25]([C:26]([F:27])([F:28])[F:29])(=[O:30])=[O:31])(=[O:32])=[O:33])([F:34])[F:35].[c:1]1([P:2](=[O:3])([c:4]2[cH:5][cH:6][cH:7][cH:8][cH:9]2)[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:16][cH:17][cH:18][cH:19][cH:20]1.[c:82]1([S:83][CH3:84])[cH:85][cH:86][cH:87][cH:88][cH:89]1>>[S:43]1[CH:44]([CH:77]([O:78][CH3:79])[O:80][CH3:81])[CH2:45][N:46]=[C:47]1[c:49]1[nH:50][c:51]2[c:52]([N:66]([S:67](=[O:68])(=[O:69])[c:70]3[n:71][cH:72][cH:73][cH:74][cH:75]3)[CH3:76])[cH:53][c:54]([O:58][CH2:59][CH2:60][CH2:61][S:62](=[O:63])(=[O:64])[CH3:65])[cH:55][c:56]2[cH:57]1Participants
7
Sources & evidence
- ORD record
- ord-f3b81efd06a74360b73192252a6002cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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