HCID 672599, compound → HCID 178464750, compound

HRID 1120070Notes

Reaction equation

HRID 1120070 reaction equation
[n:1]1[s:2][n:3][c:4]2[c:5]([S:6]([NH:7][c:8]3[cH:9][cH:10][cH:11][cH:12][c:13]3[C:14]([OH:15])=[O:16])(=[O:17])=[O:18])[cH:19][cH:20][cH:21][c:22]12.[n:23]1[c:24]2[c:25]([n:26][s:27]1)[c:28]([S:32](=[O:33])(=[O:34])[NH:35][c:36]1[c:37]([C:38](=[O:39])[NH:40][CH:41]([CH3:42])[c:43]3[c:44]([F:50])[cH:45][c:46]([F:49])[cH:47][cH:48]3)[cH:51][cH:52][c:53]([C:55]([F:56])([F:57])[F:58])[cH:54]1)[cH:29][cH:30][cH:31]2>>[n:23]1[c:24]2[c:25]([n:26][s:27]1)[c:28]([S:32](=[O:33])(=[O:34])[NH:35][c:36]1[c:37]([C:38](=[O:39])[NH:40][CH:41]([CH3:42])[c:43]3[c:44]([F:50])[cH:45][c:46]([F:49])[cH:47][cH:48]3)[cH:51][cH:52][cH:53][cH:54]1)[cH:29][cH:30][cH:31]2

Participants

3

Reactant 2

HCID 672599HCID 672599, compoundHCID 11455522HCID 11455522, compound

Product 1

HCID 178464750HCID 178464750, compound

Sources & evidence

ORD record
ord-47681ec6f9734105b92698ff9281590c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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