Water → HCID 68464475, compound

HRID 1201848Notes

Reaction equation

HRID 1201848 reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][n:7][c:8]([N:11]2[CH2:12][c:13]3[c:14]([nH:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[cH:23][c:24]([CH2:28][N:29]6[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]6)[cH:25][cH:26][cH:27]5)[cH:20][c:21]34)[CH2:35][CH2:36]2)[n:9][cH:10]1.[CH3:37][S:38]([Cl:39])(=[O:40])=[O:41].[CH3:45][N:46]([CH3:47])[c:48]1[cH:49][cH:50][n:51][cH:52][cH:53]1.[Cl:42][CH2:43][Cl:44].[OH2:54]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][n:7][c:8]([N:11]2[CH2:12][c:13]3[c:14]([nH:15][c:16]4[cH:17][cH:18][c:19](-[c:22]5[cH:23][c:24]([CH2:28][N:29]6[CH2:30][CH2:31][N:32]([S:38]([CH3:37])(=[O:40])=[O:41])[CH2:33][CH2:34]6)[cH:25][cH:26][cH:27]5)[cH:20][c:21]34)[CH2:35][CH2:36]2)[n:9][cH:10]1

Participants

6

Sources & evidence

ORD record
ord-52519edbb7bf450cb32f1fae89cc4fd5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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