Dichloromethane → trans-N-(2-dimethylamino-ethyl)-N-methyl-3-{4-[methyl-(4-trifluoromethyl-benzenesulfonyl)-amino]-cyclohexyloxy}-propionamide

HRID 174607Notes

Reaction equation

HRID 174607 reaction equation
[CH3:1][N:2]([CH:3]1[CH2:4][CH2:5][CH:6]([O:9][CH2:10][CH2:11][C:12](=[O:13])[OH:14])[CH2:7][CH2:8]1)[S:15](=[O:16])(=[O:17])[c:18]1[cH:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]1.[CH3:28][N:29]([CH2:30][CH2:31][NH:32][CH3:33])[CH3:34].[CH3:35][CH2:36][N:37]=[C:38]=[N:39][CH2:40][CH2:41][CH2:42][N:43]([CH3:44])[CH3:45].[Cl:56][CH2:57][Cl:58].[OH:46][n:47]1[c:48]2[c:49]([cH:50][cH:51][cH:52][cH:53]2)[n:54][n:55]1>>[CH3:1][N:2]([CH:3]1[CH2:4][CH2:5][CH:6]([O:9][CH2:10][CH2:11][C:12](=[O:14])[N:32]([CH2:31][CH2:30][N:29]([CH3:28])[CH3:34])[CH3:33])[CH2:7][CH2:8]1)[S:15](=[O:16])(=[O:17])[c:18]1[cH:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 673381,2-Ethanediamine, N1,N1,N2-trimethyl-HCID 757711-HydroxybenzotriazoleHCID 11538772trans-3-{4-[Methyl-(4-trifluoromethyl-benzenesulfonyl)-amino]-cyclohexyloxy}-propionic acid

Product 1

HCID 11317890trans-N-(2-dimethylamino-ethyl)-N-methyl-3-{4-[methyl-(4-trifluoromethyl-benzenesulfonyl)-amino]-cyclohexyloxy}-propionamide

Sources & evidence

ORD record
ord-1da559909002411f9009f1060d67fdd4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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