Toluene → HCID 10199501, compound

HRID 315838Notes

Reaction equation

HRID 315838 reaction equation
[CH3:13][c:14]1[cH:15][cH:16][c:17]([S:18]([O:19][CH2:24][CH:25]([CH2:26][S:27][c:28]2[c:29]([O:34][CH3:35])[cH:30][cH:31][cH:32][cH:33]2)[CH3:36])(=[O:20])=[O:21])[cH:22][cH:23]1.[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[O:1]1[CH2:2][CH:3]([NH2:12])[CH2:4][S:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2>>[O:1]1[CH2:2][CH:3]([NH:12][CH2:24][CH:25]([CH2:26][S:27][c:28]2[c:29]([O:34][CH3:35])[cH:30][cH:31][cH:32][cH:33]2)[CH3:36])[CH2:4][S:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2

Participants

5

Reactant 4

HCID 1140TolueneHCID 8471TriethylamineHCID 21950135HCID 21950135, compoundHCID 87353194HCID 87353194, compound

Product 1

HCID 10199501HCID 10199501, compound

Sources & evidence

ORD record
ord-124361f2b6984ae2b6df1fae6ebc2e1b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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