Water → HCID 86642491, compound

HRID 691505Notes

Reaction equation

HRID 691505 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[Cl:12])[cH:7][cH:8]1.[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:45][N:46]([c:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1)[CH3:53].[O:13]=[c:14]1[nH:15][c:16]2[c:17]([n:18]1[CH:19]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[cH:33][cH:34][cH:35][cH:36]2.[O:54]1[CH2:55][CH2:56][CH2:57][CH2:58]1.[OH2:44]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[n:15]2[c:14](=[O:13])[n:18]([CH:19]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[c:17]3[c:16]2[cH:36][cH:35][cH:34][cH:33]3)[cH:7][cH:8]1

Participants

7

Sources & evidence

ORD record
ord-05c129e1186d40bb88889751e7c14273
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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