Dimethyl Sulfoxide → HCID 59002902, compound

HRID 138240Notes

Reaction equation

HRID 138240 reaction equation
[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][O:41][c:42]1[cH:43][cH:44][c:45]([CH2:46][NH2:47])[cH:48][cH:49]1.[CH3:51][S:52]([CH3:53])=[O:54].[CH:1]1([n:4]2[c:5]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:6][c:7](=[O:27])[c:8]3[c:9]([F:26])[c:10]([F:25])[c:11]([NH:15][CH2:16][CH2:17][NH:18][c:19]4[n:20][cH:21][cH:22][cH:23][cH:24]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1.[OH2:50]>>[CH:1]1([n:4]2[c:5]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:6][c:7](=[O:27])[c:8]3[c:9]([NH:47][CH2:46][c:45]4[cH:44][cH:43][c:42]([O:41][CH3:40])[cH:49][cH:48]4)[c:10]([F:25])[c:11]([NH:15][CH2:16][CH2:17][NH:18][c:19]4[n:20][cH:21][cH:22][cH:23][cH:24]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 8471TriethylamineHCID 754524-MethoxybenzylamineHCID 59002828HCID 59002828, compound

Product 1

HCID 59002902HCID 59002902, compound

Sources & evidence

ORD record
ord-9d4f5d256b454806a7f8a51ed1855b4b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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