Toluene → HCID 178495902, compound

HRID 952180Notes

Reaction equation

HRID 952180 reaction equation
[CH3:86][c:87]1[cH:88][cH:89][cH:90][cH:91][cH:92]1.[Cl:1][c:2]1[c:3]([NH:40][S:41](=[O:42])(=[O:43])[CH3:44])[n:4][c:5]([N:30]([CH2:31][CH:32]2[CH:33]([CH3:35])[CH2:34]2)[CH2:36][CH2:37][O:38][CH3:39])[cH:6][c:7]1-[c:8]1[n:9][n:10][c:11]([C:13]([CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)([CH3:21])[NH:22][C:23]([O:24][C:25]([CH3:26])([CH3:27])[CH3:28])=[O:29])[o:12]1.[O:72]=[C:73]([O:74][CH:75]([CH3:76])[CH3:77])[N:78]=[N:79][C:80]([O:81][CH:82]([CH3:83])[CH3:84])=[O:85].[OH:45][CH2:46][c:47]1[n:48][cH:49][cH:50][cH:51][cH:52]1.[c:53]1([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[Cl:1][c:2]1[c:3]([N:40]([S:41](=[O:42])(=[O:43])[CH3:44])[CH2:46][c:47]2[n:48][cH:49][cH:50][cH:51][cH:52]2)[n:4][c:5]([N:30]([CH2:31][CH:32]2[CH:33]([CH3:35])[CH2:34]2)[CH2:36][CH2:37][O:38][CH3:39])[cH:6][c:7]1-[c:8]1[n:9][n:10][c:11]([C:13]([CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)([CH3:21])[NH:22][C:23]([O:24][C:25]([CH3:26])([CH3:27])[CH3:28])=[O:29])[o:12]1

Participants

6

Sources & evidence

ORD record
ord-3c2a6ea1f9a3416486ff5c57336456e0
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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