Water → HCID 58092094, compound

HRID 1539403Notes

Reaction equation

HRID 1539403 reaction equation
[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:37][S:38]([Cl:39])(=[O:40])=[O:41].[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:26]([F:27])([F:28])[F:29])[CH2:10][N:11]=[C:12]([c:14]3[cH:15][cH:16][c:17]([CH2:24][OH:25])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]34)[CH2:13]2)[cH:5][c:6]([Cl:8])[cH:7]1.[OH2:42]>>[Cl:1][c:2]1[cH:3][c:4]([C:9]2([C:26]([F:27])([F:28])[F:29])[CH2:10][N:11]=[C:12]([c:14]3[cH:15][cH:16][c:17]([CH2:24][O:25][S:38]([CH3:37])(=[O:40])=[O:41])[c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]34)[CH2:13]2)[cH:5][c:6]([Cl:8])[cH:7]1

Participants

6

Sources & evidence

ORD record
ord-cbf36e97d7614dbcb432bee6f5c19dac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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