Methanesulfonic Acid → HCID 25096698, compound

HRID 691931Notes

Reaction equation

HRID 691931 reaction equation
[CH3:1][c:2]1[cH:3][c:4]([N:5]2[CH2:6][CH2:7][N:8]([CH2:9][CH2:10][O:11][c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[C:18]2=[O:19])[s:20][c:21]1[C:22]([OH:23])=[O:24].[CH3:48][S:49]([OH:50])(=[O:51])=[O:52].[F:25][c:26]1[cH:27][cH:28][c:29]([CH2:30][N:31]2[C:32](=[O:45])[N:33]([c:36]3[cH:37][c:38]([CH3:44])[c:39]([C:41](=[O:42])[OH:43])[s:40]3)[CH2:34][CH2:35]2)[cH:46][cH:47]1.[nH:53]1[c:54]([CH2:62][NH2:63])[cH:55][c:56]2[cH:57][cH:58][cH:59][cH:60][c:61]12>>[F:25][c:26]1[cH:27][cH:28][c:29]([CH2:30][N:31]2[C:32](=[O:45])[N:33]([c:36]3[cH:37][c:38]([CH3:44])[c:39]([C:41](=[O:43])[NH:63][CH2:62][c:54]4[nH:53][c:61]5[c:56]([cH:55]4)[cH:57][cH:58][cH:59][cH:60]5)[s:40]3)[CH2:34][CH2:35]2)[cH:46][cH:47]1

Participants

5

Reactant 4

HCID 6395Methanesulfonic AcidHCID 582331(1h-indol-2-ylmethyl)amineHCID 580314563-Methyl-5-(2-oxo-3-(2-phenoxyethyl)imidazolidin-1-yl)thiophene-2-carboxylic acidHCID 580314655-(3-(4-Fluorobenzyl)-2-oxoimidazolidin-1-yl)-3-methylthiophene-2-carboxylic acid

Product 1

HCID 25096698HCID 25096698, compound

Sources & evidence

ORD record
ord-94c86c879d344063ab1b817325f27b0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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