Toluene → HCID 59355205, compound

HRID 319026Notes

Reaction equation

HRID 319026 reaction equation
[CH3:1][CH:2]1[CH2:3][N:4]([S:9](=[O:10])(=[O:11])[c:12]2[cH:13][c:14]3[c:15](=[O:38])[c:16]4[cH:17][c:18]([S:27](=[O:28])(=[O:29])[N:30]5[CH2:31][CH:32]([CH3:37])[CH2:33][CH:34]([CH3:36])[CH2:35]5)[cH:19][cH:20][c:21]4[n:22]([CH3:26])[c:23]3[cH:24][cH:25]2)[CH2:5][CH:6]([CH3:8])[CH2:7]1.[CH3:39][O:40][c:41]1[cH:42][cH:43][c:44]([P:45]2(=[S:48])[S:46][P:47]([c:49]3[cH:50][cH:51][c:52]([O:53][CH3:54])[cH:55][cH:56]3)(=[S:57])[S:58]2)[cH:59][cH:60]1.[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1>>[CH3:1][CH:2]1[CH2:3][N:4]([S:9](=[O:10])(=[O:11])[c:12]2[cH:13][c:14]3[c:15](=[S:48])[c:16]4[cH:17][c:18]([S:27](=[O:28])(=[O:29])[N:30]5[CH2:31][CH:32]([CH3:37])[CH2:33][CH:34]([CH3:36])[CH2:35]5)[cH:19][cH:20][c:21]4[n:22]([CH3:26])[c:23]3[cH:24][cH:25]2)[CH2:5][CH:6]([CH3:8])[CH2:7]1

Participants

4

Sources & evidence

ORD record
ord-4301551563b9411180a0c5dc0e13cb3b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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