Water → HCID 22031841, compound

HRID 1127151Notes

Reaction equation

HRID 1127151 reaction equation
[CH3:48][CH2:49][N:50]([CH2:51][CH3:52])[CH2:53][CH3:54].[CH3:55][S:56](=[O:57])(=[O:58])[Cl:59].[Cl:61][CH2:62][Cl:63].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]([C:29]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)([c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[cH:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]3[n:17]([cH:18]2)[c:19](-[c:22]2[cH:23][cH:24][c:25]([NH2:26])[cH:27][cH:28]2)[cH:20][n:21]3)[cH:6][cH:7]1.[OH2:60]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]([C:29]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)([c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[cH:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]3[n:17]([cH:18]2)[c:19](-[c:22]2[cH:23][cH:24][c:25]([NH:26][S:56]([CH3:55])(=[O:57])=[O:58])[cH:27][cH:28]2)[cH:20][n:21]3)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 22031454HCID 22031454, compound

Product 1

HCID 22031841HCID 22031841, compound

Sources & evidence

ORD record
ord-0963c40126744fe88600191867edc718
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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