Water → HCID 178495486, compound

HRID 663923Notes

Reaction equation

HRID 663923 reaction equation
[C:39](=[O:40])([O-:41])[O-:42].[CH3:15][O:16][CH2:17][CH:18]([O:19][c:20]1[cH:21][c:22]([OH:37])[cH:23][c:24](-[c:26]2[nH:27][c:28]([C:31]3=[N:35][CH2:34][CH:33]([CH3:36])[O:32]3)[cH:29][cH:30]2)[cH:25]1)[CH3:38].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[Cs+:43].[Cs+:44].[N:1]1([S:5](=[O:6])(=[O:7])[c:8]2[n:9][cH:10][c:11]([Cl:14])[cH:12][cH:13]2)[CH2:2][CH2:3][CH2:4]1.[OH2:45]>>[N:1]1([S:5](=[O:6])(=[O:7])[c:8]2[n:9][cH:10][c:11]([O:37][c:22]3[cH:21][c:20]([O:19][CH:18]([CH2:17][O:16][CH3:15])[CH3:38])[cH:25][c:24](-[c:26]4[nH:27][c:28]([C:31]5=[N:35][CH2:34][CH:33]([CH3:36])[O:32]5)[cH:29][cH:30]4)[cH:23]3)[cH:12][cH:13]2)[CH2:2][CH2:3][CH2:4]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 666833922-(Azetidin-1-ylsulfonyl)-5-chloropyridineHCID 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 178495486HCID 178495486, compound

Sources & evidence

ORD record
ord-fe79a72a51254e2faa0331659322b0b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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