Water → HCID 178481531, compound
Reaction equation
[CH3:54][CH:55]([CH3:56])[CH2:57][CH:58]([OH:59])[CH3:60].[Cl:35][c:36]1[n:37][cH:38][c:39]2[c:45]([n:46]1)[N:44]([CH:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1)[CH2:43][CH2:42][C:41](=[O:52])[N:40]2[CH3:53].[NH2:13][c:14]1[cH:15][c:16]([F:34])[c:17]([C:18](=[O:19])[NH:20][CH:21]2[CH2:22][CH:23]3[CH2:24][CH2:25][CH2:26][CH:27]([CH2:28]2)[N:29]3[CH3:30])[cH:31][c:32]1[F:33].[OH2:1].[c:2]1([CH3:3])[cH:4][cH:5][c:6]([S:7]([OH:8])(=[O:9])=[O:10])[cH:11][cH:12]1>>[NH:13]([c:14]1[cH:15][c:16]([F:34])[c:17]([C:18](=[O:19])[NH:20][CH:21]2[CH2:22][CH:23]3[CH2:24][CH2:25][CH2:26][CH:27]([CH2:28]2)[N:29]3[CH3:30])[cH:31][c:32]1[F:33])[c:36]1[n:37][cH:38][c:39]2[c:45]([n:46]1)[N:44]([CH:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1)[CH2:43][CH2:42][C:41](=[O:52])[N:40]2[CH3:53]Participants
6
Sources & evidence
- ORD record
- ord-867d0a3c95054b68a6b47874c1499fd9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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