Toluene → HCID 86739128, compound

HRID 679445Notes

Reaction equation

HRID 679445 reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl:8][C:9](=[O:10])[N:11]([O:12][c:13]1[cH:14][n:15][n:16]([CH:18]([CH3:19])[CH3:20])[cH:17]1)[CH:21]=[C:22]=[O:23].[SH:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[C:9]([N:11]([O:12][c:13]1[cH:14][n:15][n:16]([CH:18]([CH3:19])[CH3:20])[cH:17]1)[CH:21]=[C:22]=[O:23])(=[S:24])[c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 7969ThiophenolHCID 8471TriethylamineHCID 86739129HCID 86739129, compound

Product 1

HCID 86739128HCID 86739128, compound

Sources & evidence

ORD record
ord-e4ca296e2fb349f1a028204e4b7f1630
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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