Hydrochloric Acid → HCID 87122705, compound
Reaction equation
[C:55]([CH3:56])(=[O:57])[NH:58][c:59]1[s:60][c:61]([S:65](=[O:66])(=[O:67])[Cl:68])[c:62]([CH3:64])[n:63]1.[CH3:2][O:3][C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10](-[c:13]2[cH:14][cH:15][c:16]([C:19]#[N:20])[cH:17][cH:18]2)[cH:11][cH:12]1)[NH:21][C:22](=[O:23])[CH:24]1[NH:25][CH2:26][c:27]2[cH:28][c:29]3[c:30]([cH:31][c:32]2[CH2:33]1)[O:34][CH2:35][CH:36]([c:38]1[cH:39][cH:40][c:41]([O:44][CH2:45][c:46]2[cH:47][c:48]([CH3:53])[c:49]([CH3:52])[cH:50][cH:51]2)[cH:42][cH:43]1)[O:37]3)=[O:54].[ClH:1]>>[CH3:2][O:3][C:4]([CH:5]([CH2:6][c:7]1[cH:8][cH:9][c:10](-[c:13]2[cH:14][cH:15][c:16]([C:19]#[N:20])[cH:17][cH:18]2)[cH:11][cH:12]1)[NH:21][C:22](=[O:23])[CH:24]1[N:25]([S:65]([c:61]2[s:60][c:59]([NH:58][C:55]([CH3:56])=[O:57])[n:63][c:62]2[CH3:64])(=[O:66])=[O:67])[CH2:26][c:27]2[cH:28][c:29]3[c:30]([cH:31][c:32]2[CH2:33]1)[O:34][CH2:35][CH:36]([c:38]1[cH:39][cH:40][c:41]([O:44][CH2:45][c:46]2[cH:47][c:48]([CH3:53])[c:49]([CH3:52])[cH:50][cH:51]2)[cH:42][cH:43]1)[O:37]3)=[O:54]Participants
4
Sources & evidence
- ORD record
- ord-a7398c1515044881906da594d4ce4187
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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