Toluene → HCID 15411299, compound

HRID 134246Notes

Reaction equation

HRID 134246 reaction equation
[CH3:34][O:35][c:36]1[cH:37][cH:38][c:39]([P:40]2(=[S:43])[S:41][P:42]([c:44]3[cH:45][cH:46][c:47]([O:48][CH3:49])[cH:50][cH:51]3)(=[S:52])[S:53]2)[cH:54][cH:55]1.[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Cl:63][CH:64]([Cl:65])[Cl:66].[n:1]1[c:2]([CH2:11][O:12][c:13]2[cH:14][c:15]([CH2:16][O:17][c:18]3[c:19]4[c:23]([c:24]([CH3:27])[cH:25][cH:26]3)[NH:22][C:21](=[O:28])[C:20]4([CH3:29])[CH3:30])[cH:31][cH:32][cH:33]2)[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[n:1]1[c:2]([CH2:11][O:12][c:13]2[cH:14][c:15]([CH2:16][O:17][c:18]3[c:19]4[c:23]([c:24]([CH3:27])[cH:25][cH:26]3)[NH:22][C:21](=[S:43])[C:20]4([CH3:29])[CH3:30])[cH:31][cH:32][cH:33]2)[cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12

Participants

5

Sources & evidence

ORD record
ord-67916bdac6ae4c5d91672f276732f2bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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