Dimethyl Sulfoxide → HCID 69668344, compound

HRID 1236264Notes

Reaction equation

HRID 1236264 reaction equation
[CH3:71][S:72]([CH3:73])=[O:74].[CH:59]([N:60]([CH2:61][CH3:62])[CH:63]([CH3:64])[CH3:65])([CH3:66])[CH3:67].[Cl:30][c:31]1[cH:32][c:33]([NH:38][c:39]2[n:40][cH:41][n:42][c:43]3[cH:44][c:45]([O:56][CH2:57][CH3:58])[cH:46][c:47]([O:49][CH2:50][CH:51]4[NH:52][CH2:53][CH2:54][CH2:55]4)[c:48]23)[cH:34][cH:35][c:36]1[F:37].[Cl:68][CH2:69][Cl:70].[OH:1][CH2:2][C:3]([OH:4])=[O:5].[P-:6]([F:7])([F:8])([F:9])([F:10])([F:11])[F:12].[n:13]1([O:14][C:15]([N:16]([CH3:17])[CH3:18])=[N+:19]([CH3:20])[CH3:21])[c:22]2[n:23][cH:24][cH:25][cH:26][c:27]2[n:28][n:29]1>>[OH:1][CH2:2][C:3](=[O:5])[N:52]1[CH:51]([CH2:50][O:49][c:47]2[cH:46][c:45]([O:56][CH2:57][CH3:58])[cH:44][c:43]3[n:42][cH:41][n:40][c:39]([NH:38][c:33]4[cH:32][c:31]([Cl:30])[c:36]([F:37])[cH:35][cH:34]4)[c:48]32)[CH2:55][CH2:54][CH2:53]1

Participants

8

Reactant 7

HCID 679Dimethyl SulfoxideHCID 757Glycolic AcidHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178467011HCID 178467011, compound

Product 1

HCID 69668344HCID 69668344, compound

Sources & evidence

ORD record
ord-7f24dd219fb6426b8efb8a80042456cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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