Toluene → HCID 57795426, compound

HRID 1540044Notes

Reaction equation

[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([Sn:27]([CH2:28][CH2:29][CH2:30][CH3:31])([CH2:32][CH2:33][CH2:34][CH3:35])[CH2:36][CH2:37][CH2:38][CH3:39])[cH:8][c:9]1[N:10]([C:11](=[O:12])[CH:13]1[CH2:14][CH2:15][CH:16]([CH3:19])[CH2:17][CH2:18]1)[CH:20]1[CH2:21][CH2:22][CH:23]([OH:26])[CH2:24][CH2:25]1.[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[O:40]([c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)[CH:47]1[CH2:48][CH:49]=[C:50]([O:53][S:54]([C:55]([F:56])([F:57])[F:58])(=[O:59])=[O:60])[CH2:51][CH2:52]1.[cH:68]1[cH:69][cH:70][c:71]([P:72]([Pd:73]([P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)([P:93]([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[P:112]([c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)([c:119]2[cH:120][cH:121][cH:122][cH:123][cH:124]2)[c:125]2[cH:126][cH:127][cH:128][cH:129][cH:130]2)([c:131]2[cH:132][cH:133][cH:134][cH:135][cH:136]2)[c:137]2[cH:138][cH:139][cH:140][cH:141][cH:142]2)[cH:143][cH:144]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([C:50]2=[CH:49][CH2:48][CH:47]([O:40][c:41]3[cH:42][cH:43][cH:44][cH:45][cH:46]3)[CH2:52][CH2:51]2)[cH:8][c:9]1[N:10]([C:11](=[O:12])[CH:13]1[CH2:14][CH2:15][CH:16]([CH3:19])[CH2:17][CH2:18]1)[CH:20]1[CH2:21][CH2:22][CH:23]([OH:26])[CH2:24][CH2:25]1

Participants

Reactant 4

HCID 1140Toluene

HCID 57795386HCID 57795386, compound

HCID 57795423HCID 57795423, compound

HCID 178420554HCID 178420554, compound

Product 1

HCID 57795426HCID 57795426, compound

Sources & evidence

ORD record: ord-12ac14294c0448c39fdd4f8d63d1c65d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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