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Dimethyl Sulfoxide → N2-(2-chloro-4-(methylcarbamoyl)phenyl)-N2-methyl-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2,9-dicarboxamide

HRID 1221557
Notes
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Reaction equation

HRID 1221557 reaction equation
[C:32]([O-:33])(=[O:34])[O-:35].[CH3:40][S:41]([CH3:42])=[O:43].[Cl:1][c:2]1[c:3]([N:12]([C:13](=[O:14])[c:15]2[cH:16][c:17]3[c:18]([s:30]2)-[c:19]2[c:20]([cH:24][cH:25][c:26]([C:28]#[N:29])[cH:27]2)[O:21][CH2:22][CH2:23]3)[CH3:31])[cH:4][cH:5][c:6]([C:8]([NH:9][CH3:10])=[O:11])[cH:7]1.[K+:36].[K+:37].[OH2:44].[OH:38][OH:39]>>[Cl:1][c:2]1[c:3]([N:12]([C:13](=[O:14])[c:15]2[cH:16][c:17]3[c:18]([s:30]2)-[c:19]2[c:20]([cH:24][cH:25][c:26]([C:28]([NH2:29])=[O:33])[cH:27]2)[O:21][CH2:22][CH2:23]3)[CH3:31])[cH:4][cH:5][c:6]([C:8]([NH:9][CH3:10])=[O:11])[cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 784Hydrogen PeroxideHCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 57900333N-(2-chloro-4-(methylcarbamoyl)phenyl)-9-cyano-N-methyl-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2-carboxamide

Product 1

HCID 57900126
N2-(2-chloro-4-(methylcarbamoyl)phenyl)-N2-methyl-4,5-dihydrobenzo[b]thieno[2,3-d]oxepine-2,9-dicarboxamide

Sources & evidence

ORD record
ord-0f92cee244bb4d6bb38eb2fb13c1e4f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes