Chloride → HCID 54189344, compound

HRID 2159123Notes

Reaction equation

HRID 2159123 reaction equation
[CH3:1][CH:2]([CH3:3])[c:4]1[cH:5][c:6]2[c:7](=[O:19])[n:8]([CH:14]=[CH:15][C:16](=[O:17])[OH:18])[cH:9][n:10][c:11]2[cH:12][cH:13]1.[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[Cl-:24].[S:20]([Cl:21])([Cl:22])=[O:23].[n:25]1[c:26]([NH:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][NH2:38])[cH:27][cH:28][cH:29][cH:30]1>>[CH3:1][CH:2]([CH3:3])[c:4]1[cH:5][c:6]2[c:7](=[O:19])[n:8]([CH:14]=[CH:15][C:16](=[O:18])[NH:38][CH2:37][CH2:36][CH2:35][CH2:34][CH2:33][CH2:32][NH:31][c:26]3[n:25][cH:30][cH:29][cH:28][cH:27]3)[cH:9][n:10][c:11]2[cH:12][cH:13]1

Participants

6

Reactant 5

HCID 312ChlorideHCID 1140TolueneHCID 24386Thionyl ChlorideHCID 23313641HCID 23313641, compoundHCID 54306422HCID 54306422, compound

Product 1

HCID 54189344HCID 54189344, compound

Sources & evidence

ORD record
ord-4555d7e037ae4b579a8251c7bd0eeeff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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