Water → HCID 11721247, compound

HRID 1546846Notes

Reaction equation

HRID 1546846 reaction equation
[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[Cl:1][c:2]1[c:3](-[c:9]2[n:10](-[c:24]3[cH:25][cH:26][c:27]([OH:30])[cH:28][cH:29]3)[c:11]([CH3:23])[c:12]([C:14](=[O:15])[NH:16][N:17]3[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]3)[n:13]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cl:49][CH2:50][Cl:51].[OH2:48].[n:38]1[cH:39][c:40]([S:44](=[O:45])(=[O:46])[Cl:47])[cH:41][cH:42][cH:43]1>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10](-[c:24]3[cH:25][cH:26][c:27]([O:30][S:44]([c:40]4[cH:39][n:38][cH:43][cH:42][cH:41]4)(=[O:45])=[O:46])[cH:28][cH:29]3)[c:11]([CH3:23])[c:12]([C:14](=[O:15])[NH:16][N:17]3[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]3)[n:13]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

6

Sources & evidence

ORD record
ord-18f857ddab9248c8b424f4ca767a15b2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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