Water → HCID 86605501, compound

HRID 676074Notes

Reaction equation

HRID 676074 reaction equation
[Br:18][c:19]1[c:20]([N:25]=[C:26]=[S:27])[cH:21][cH:22][cH:23][cH:24]1.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:13]([c:14]([CH3:17])[c:15]1[CH3:16])[NH:12][CH2:11][C:7]1([CH2:6]2)[CH2:8][CH2:9][CH2:10]1.[Cl:29][CH2:30][Cl:31].[OH2:28]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:13]([c:14]([CH3:17])[c:15]1[CH3:16])[N:12]([C:26]([NH:25][c:20]1[c:19]([Br:18])[cH:24][cH:23][cH:22][cH:21]1)=[S:27])[CH2:11][C:7]1([CH2:6]2)[CH2:8][CH2:9][CH2:10]1

Participants

5

Sources & evidence

ORD record
ord-2297dacabeea4b30810d7fcb438202d8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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