Water → HCID 178495487, compound

HRID 2162757Notes

Reaction equation

HRID 2162757 reaction equation
[C:54](=[O:55])([O-:56])[O-:57].[CH3:30][O:31][CH2:32][CH:33]([O:34][c:35]1[cH:36][c:37]([OH:52])[cH:38][c:39](-[c:41]2[nH:42][c:43]([C:46]3=[N:50][CH2:49][CH:48]([CH3:51])[O:47]3)[cH:44][cH:45]2)[cH:40]1)[CH3:53].[CH3:61][N:62]([CH3:63])[CH:64]=[O:65].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][c:13]2[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]2)[CH2:21][c:22]2[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]2)[n:6][cH:7]1.[Cs+:58].[Cs+:59].[OH2:60]>>[c:2]1([O:52][c:37]2[cH:36][c:35]([O:34][CH:33]([CH2:32][O:31][CH3:30])[CH3:53])[cH:40][c:39](-[c:41]3[nH:42][c:43]([C:46]4=[N:50][CH2:49][CH:48]([CH3:51])[O:47]4)[cH:44][cH:45]3)[cH:38]2)[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][c:13]2[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]2)[CH2:21][c:22]2[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]2)[n:6][cH:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 666833875-Chloro-N,N-bis(4-methoxybenzyl)pyridine-2-sulfonamideHCID 1784955173-(1-methoxypropan-2-yloxy)-5-[5-(5-methyl-4,5-dihydro-1,3-oxazol-2-yl)-1H-pyrrol-2-yl]phenol

Product 1

HCID 178495487HCID 178495487, compound

Sources & evidence

ORD record
ord-c3044cc528a24f878bdd613569f5a51c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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