Dichloromethane → HCID 11756624, compound

HRID 1573052Notes

Reaction equation

HRID 1573052 reaction equation
[CH2:24]([N:25]([CH2:26][CH3:27])[CH2:28][CH3:29])[CH3:30].[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[Cl:21][CH2:22][Cl:23].[N:31](=[C:32]=[O:33])[c:34]1[cH:35][c:36]([C:44]([F:45])([F:46])[F:47])[cH:37][c:38]([C:40]([F:41])([F:42])[F:43])[cH:39]1.[n:1]1[cH:2][cH:3][c:4]([CH2:7][O:8][c:9]2[c:10]([N:15]3[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]3)[n:11][cH:12][cH:13][n:14]2)[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4]([CH2:7][O:8][c:9]2[c:10]([N:15]3[CH2:16][CH2:17][N:18]([C:32]([NH:31][c:34]4[cH:35][c:36]([C:44]([F:45])([F:46])[F:47])[cH:37][c:38]([C:40]([F:41])([F:42])[F:43])[cH:39]4)=[O:33])[CH2:19][CH2:20]3)[n:11][cH:12][cH:13][n:14]2)[cH:5][cH:6]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 27333143,5-Bis(trifluoromethyl)phenyl isocyanateHCID 59013957HCID 59013957, compound

Product 1

HCID 11756624HCID 11756624, compound

Sources & evidence

ORD record
ord-7a957ece8f4e4072bcfc2682658571ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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