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Chloride → 3-Chloro-1-(3-chloro-4-methoxyphenyl)-5-(4-methylsulfanylphenyl)pyrazole

HRID 89218
Notes
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Reaction equation

HRID 89218 reaction equation
[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[CH3:42][C:43]#[N:44].[Cl-:1].[Cl-:3].[Cl:12][c:13]1[cH:14][c:15](-[n:21]2[n:22][c:23]([NH2:34])[cH:24][c:25]2-[c:26]2[cH:27][cH:28][c:29]([S:32][CH3:33])[cH:30][cH:31]2)[cH:16][cH:17][c:18]1[O:19][CH3:20].[ClH:35].[Li+:2].[N+:4]([O-:5])([O:6][CH2:7][CH2:8][CH2:9][CH3:10])=[O:11]>>[Cl:1][c:23]1[n:22][n:21](-[c:15]2[cH:14][c:13]([Cl:12])[c:18]([O:19][CH3:20])[cH:17][cH:16]2)[c:25](-[c:26]2[cH:27][cH:28][c:29]([S:32][CH3:33])[cH:30][cH:31]2)[cH:24]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 312Chloride2×HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 13567Butyl nitrateHCID 28486Lithium ionHCID 183553981-(3-Chloro-4-methoxyphenyl)-5-(4-methylsulfanylphenyl)pyrazol-3-amine

Product 1

HCID 183554103-Chloro-1-(3-chloro-4-methoxyphenyl)-5-(4-methylsulfanylphenyl)pyrazole

Sources & evidence

ORD record
ord-93913861c43044e597f4e13471623783
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes