Toluene → HCID 10723563, compound

HRID 2136381Notes

Reaction equation

HRID 2136381 reaction equation
[CH2:54]([P:55]([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH3:66].[CH3:85][c:86]1[cH:87][cH:88][cH:89][cH:90][cH:91]1.[N:67]([C:68]([N:69]1[CH2:70][CH2:71][CH2:72][CH2:73][CH2:74]1)=[O:75])=[N:76][C:77]([N:78]1[CH2:79][CH2:80][CH2:81][CH2:82][CH2:83]1)=[O:84].[OH:1][CH2:2][c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([S:11][c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[cH:9][cH:10]2)[n:18]1[CH3:19].[OH:20][c:21]1[cH:22][cH:23][c:24]([CH2:25][CH:26]2[C:27](=[O:51])[N:28]([C:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)([c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[C:29](=[O:31])[S:30]2)[cH:52][cH:53]1>>[O:1]([CH2:2][c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([S:11][c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[cH:9][cH:10]2)[n:18]1[CH3:19])[c:21]1[cH:22][cH:23][c:24]([CH2:25][CH:26]2[C:27](=[O:51])[N:28]([C:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)([c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[C:29](=[O:31])[S:30]2)[cH:52][cH:53]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 13831TributylphosphineHCID 730421,1'-(Azodicarbonyl)dipiperidineHCID 28181265-(4-Hydroxybenzyl)-3-triphenylmethylthiazolidine-2,4-dioneHCID 10849735HCID 10849735, compound

Product 1

HCID 10723563HCID 10723563, compound

Sources & evidence

ORD record
ord-a0781843b2374870aabc33936621df15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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