Acetic Acid → HCID 19597482, compound

HRID 2349079Notes

Reaction equation

HRID 2349079 reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[I+3:1]([O-:2])([O-:3])([O-:4])[O-:5].[NH2:7][c:8]1[c:9]2[c:10]([n:11][cH:12][n:13]1)[n:14]([C:30]([CH3:31])([CH3:32])[CH3:33])[cH:15][c:16]2-[c:17]1[cH:18][cH:19][c:20]([S:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:21][cH:22]1.[Na+:6].[OH2:34]>>[O:2]=[S:23]([c:20]1[cH:19][cH:18][c:17](-[c:16]2[c:9]3[c:8]([NH2:7])[n:13][cH:12][n:11][c:10]3[n:14]([C:30]([CH3:31])([CH3:32])[CH3:33])[cH:15]2)[cH:22][cH:21]1)[c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1

Participants

6

Sources & evidence

ORD record
ord-bd8ea07884524884a02c32cca2a43cb4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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