Acetophenone → HCID 136373976, compound

HRID 664896Notes

Reaction equation

HRID 664896 reaction equation
[CH3:34][N:35]([CH3:36])[C:37](=[O:38])[CH3:39].[NH2:1][n:2]1[c:3]2[c:4]([c:5]([OH:21])[c:6]([C:9]3=[N:10][S:11](=[O:19])(=[O:20])[c:12]4[c:13]([cH:15][cH:16][cH:17][cH:18]4)[NH:14]3)[c:7]1=[O:8])[s:22][cH:23][cH:24]2.[c:25]1([C:31]([CH3:32])=[O:33])[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[N:1]([n:2]1[c:3]2[c:4]([c:5]([OH:21])[c:6]([C:9]3=[N:10][S:11](=[O:19])(=[O:20])[c:12]4[c:13]([cH:15][cH:16][cH:17][cH:18]4)[NH:14]3)[c:7]1=[O:8])[s:22][cH:23][cH:24]2)=[C:31]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[CH3:32]

Participants

4

Reactant 3

HCID 7410AcetophenoneHCID 31374DimethylacetamideHCID 1363736274-amino-6-(1,1-dioxido-4H-1,2,4-benzothiadiazin-3-yl)-7-hydroxythieno[3,2-b]pyridin-5(4H)-one

Product 1

HCID 136373976HCID 136373976, compound

Sources & evidence

ORD record
ord-e4b63c3eba254375ba3c1d3137268e50
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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