Water → HCID 86585536, compound

HRID 163517Notes

Reaction equation

HRID 163517 reaction equation
[CH3:29][N:30]([CH3:31])[CH:32]=[O:33].[CH3:34][I:35].[Cl:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7](=[O:8])[c:9]2[c:10]([O:17][c:18]3[c:19]([CH3:24])[cH:20][cH:21][cH:22][cH:23]3)[n:11][c:12]([S:15][CH3:16])[n:13][cH:14]2)[cH:25][c:26]([Cl:28])[cH:27]1.[Cl:37][CH2:38][Cl:39].[OH2:36]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:5][N:6]([C:7](=[O:8])[c:9]2[c:10]([O:17][c:18]3[c:19]([CH3:24])[cH:20][cH:21][cH:22][cH:23]3)[n:11][c:12]([S:15][CH3:16])[n:13][cH:14]2)[CH3:29])[cH:25][c:26]([Cl:28])[cH:27]1

Participants

6

Sources & evidence

ORD record
ord-394f792bb05a4eb198f2c376edc3121f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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