tert-Butanol → HCID 58074093, compound
Reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7]2[c:11]([cH:12][cH:13]1)[NH:10][CH2:9][CH2:8]2.[CH3:72][C:73]([OH:74])([CH3:75])[CH3:76].[CH:37]1([PH:38][c:39]2[cH:40][cH:41][c:42](-[c:43]3[c:44]([CH:45]([CH3:46])[CH3:47])[cH:48][c:49]([CH:50]([CH3:51])[CH3:52])[cH:53][c:54]3[CH:55]([CH3:56])[CH3:57])[c:58]([PH:59][CH:60]3[CH2:61][CH2:62][CH2:63][CH2:64][CH2:65]3)[cH:66]2)[CH2:67][CH2:68][CH2:69][CH2:70][CH2:71]1.[Cl:14][c:15]1[c:16]2[c:17]([n:18][cH:19][cH:20]1)[n:21]([CH:24]1[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:28][CH2:29]1)[cH:22][cH:23]2>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7]2[c:11]([cH:12][cH:13]1)[N:10]([c:15]1[c:16]3[c:17]([n:18][cH:19][cH:20]1)[n:21]([CH:24]1[CH2:25][CH2:26][N:27]([C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:28][CH2:29]1)[cH:22][cH:23]3)[CH2:9][CH2:8]2Participants
5
Sources & evidence
- ORD record
- ord-0ed80105b04341d49143f5c2e05ba490
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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