Water → 8-(2,6-dichloro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-amide

HRID 152042Notes

Reaction equation

HRID 152042 reaction equation
[B-:40]([F:41])([F:42])([F:43])[F:44].[CH3:26][Si:27]([CH2:28][CH2:29][O:30][CH2:31][n:32]1[c:33]([NH2:37])[n:34][cH:35][cH:36]1)([CH3:38])[CH3:39].[CH3:76][CH2:77][O:78][C:79]([CH3:80])=[O:81].[CH:62]([N:63]([CH2:64][CH3:65])[CH:66]([CH3:67])[CH3:68])([CH3:69])[CH3:70].[Cl:1][c:2]1[c:3](-[c:13]2[cH:14][cH:15][c:16]([C:23](=[O:24])[OH:25])[c:17]3[n:18][cH:19][cH:20][n:21][c:22]23)[c:4]([Cl:12])[c:5]([O:10][CH3:11])[cH:6][c:7]1[O:8][CH3:9].[O:71]=[CH:72][N:73]([CH3:74])[CH3:75].[OH2:82].[n:45]1([O:46][C:47]([N:48]([CH3:49])[CH3:50])=[N+:51]([CH3:52])[CH3:53])[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2[n:60][n:61]1>>[Cl:1][c:2]1[c:3](-[c:13]2[cH:14][cH:15][c:16]([C:23](=[O:24])[NH:37][c:33]3[n:32]([CH2:31][O:30][CH2:29][CH2:28][Si:27]([CH3:26])([CH3:38])[CH3:39])[cH:36][cH:35][n:34]3)[c:17]3[n:18][cH:19][cH:20][n:21][c:22]23)[c:4]([Cl:12])[c:5]([O:10][CH3:11])[cH:6][c:7]1[O:8][CH3:9]

Participants

9

Reactant 8

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 592928388-(2,6-Dichloro-3,5-dimethoxy-phenyl)quinoxaline-5-carboxylic acidHCID 669145481-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-ylamine

Product 1

HCID 866411408-(2,6-dichloro-3,5-dimethoxy-phenyl)-quinoxaline-5-carboxylic acid [1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-amide

Sources & evidence

ORD record
ord-cab1ae5a52d941a5a4641cfbfad804ac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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