Acetone → HCID 69331863, compound

HRID 1543045Notes

Reaction equation

HRID 1543045 reaction equation
[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40].[CH3:3][CH:4]([CH3:5])[OH:6].[CH3:41][C:42](=[O:43])[CH3:44].[ClH:34].[H-:2].[NH2:7][c:8]1[n:9][c:10](-[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:11](-[c:18]2[cH:19][cH:20][c:21](=[O:27])[n:22]([CH:24]([CH3:25])[CH3:26])[n:23]2)[n:12][c:13]1[S:14]([CH3:15])(=[O:16])=[O:17].[Na+:1]>>[CH3:3][CH:4]([CH3:5])[O:6][c:13]1[c:8]([NH2:7])[n:9][c:10](-[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:11](-[c:18]2[cH:19][cH:20][c:21](=[O:27])[n:22]([CH:24]([CH3:25])[CH3:26])[n:23]2)[n:12]1

Participants

8

Sources & evidence

ORD record
ord-4774bf38e79f454c8655a122791363ba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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