Dimethyl Sulfoxide → HCID 178523271, compound

HRID 2137418Notes

Reaction equation

HRID 2137418 reaction equation
[CH3:57][S:58]([CH3:59])=[O:60].[CH:1]1([CH2:6][CH:7]([CH2:8][N:9]([CH:10]=[O:11])[O:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[C:20](=[O:21])[NH:22][NH:23][c:24]2[n:25][c:26]([Cl:32])[n:27][c:28]([Cl:31])[c:29]2[F:30])[CH2:2][CH2:3][CH2:4][CH2:5]1.[CH:48]([N:49]([CH2:50][CH3:51])[CH:52]([CH3:53])[CH3:54])([CH3:55])[CH3:56].[NH:33]1[CH:34]([CH2:38][n:39]2[n:40][n:41][c:42]3[c:43]2[n:44][cH:45][n:46][cH:47]3)[CH2:35][CH2:36][CH2:37]1>>[CH:1]1([CH2:6][CH:7]([CH2:8][N:9]([CH:10]=[O:11])[O:12][CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[C:20](=[O:21])[NH:22][NH:23][c:24]2[n:25][c:26]([Cl:32])[n:27][c:28]([N:33]3[CH:34]([CH2:38][n:39]4[n:40][n:41][c:42]5[c:43]4[n:44][cH:45][n:46][cH:47]5)[CH2:35][CH2:36][CH2:37]3)[c:29]2[F:30])[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 81531DiisopropylethylamineHCID 178420879HCID 178420879, compoundHCID 178523270HCID 178523270, compound

Product 1

HCID 178523271HCID 178523271, compound

Sources & evidence

ORD record
ord-da844a852df44faba5e9c7417c951e48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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