Water → HCID 16128669, compound

HRID 199713Notes

Reaction equation

HRID 199713 reaction equation
[CH2:19]([N:20]([CH2:21][CH3:22])[CH2:23][CH3:24])[CH3:25].[Cl:37][CH2:38][Cl:39].[OH2:40].[OH:1][CH2:2][CH2:3][NH:4][C:5](=[O:6])[c:7]1[n:8][cH:9][n:10](-[c:12]2[cH:13][c:14]([Br:18])[cH:15][cH:16][cH:17]2)[cH:11]1.[c:26]1([CH3:27])[cH:28][cH:29][c:30]([S:31]([OH:32])(=[O:33])=[O:34])[cH:35][cH:36]1>>[CH2:2]1[CH2:3][N:4]=[C:5]([c:7]2[n:8][cH:9][n:10](-[c:12]3[cH:13][c:14]([Br:18])[cH:15][cH:16][cH:17]3)[cH:11]2)[O:6]1

Participants

6

Sources & evidence

ORD record
ord-7c070320df744978997f97a348614fea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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