Hydrochloric Acid → HCID 9892894, compound

HRID 209784Notes

Reaction equation

HRID 209784 reaction equation
[CH2:35]([CH3:36])[O:37][C:38]([CH2:39][NH2:40])=[O:41].[CH2:62]([N:63]=[C:64]=[N:65][CH2:66][CH2:67][CH2:68][N:69]([CH3:70])[CH3:71])[CH3:72].[CH3:78][CH2:79][O:80][C:81]([CH3:82])=[O:83].[CH:42]([N:43]([CH:44]([CH3:45])[CH3:46])[CH2:47][CH3:48])([CH3:49])[CH3:50].[ClH:34].[ClH:61].[O:73]=[CH:74][N:75]([CH3:76])[CH3:77].[OH:51][n:52]1[c:53]2[cH:54][cH:55][cH:56][cH:57][c:58]2[n:59][n:60]1.[c:1]1(-[c:7]2[n:8][c:9]([C:18]3=[CH:23][CH2:22][CH2:21][CH2:20][CH:19]3[CH2:24][c:25]3[cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31][cH:32][cH:33]3)[o:10][c:11]2-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[n:8][c:9]([C:18]3=[CH:23][CH2:22][CH2:21][CH2:20][CH:19]3[CH2:24][c:25]3[cH:26][c:27]([C:28](=[O:30])[NH:40][CH2:39][C:38]([O:37][CH2:35][CH3:36])=[O:41])[cH:31][cH:32][cH:33]3)[o:10][c:11]2-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 12176Glycine ethyl esterHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 98458443-{(2-(4,5-Diphenyloxazol-2-yl)-2-cyclohexen-1-yl]methyl}benzoic acid

Product 1

HCID 9892894HCID 9892894, compound

Sources & evidence

ORD record
ord-9ea37d6c835347c4b604cf159d3f43fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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