Hydrochloric Acid → HCID 178464644, compound

Reaction equation

[CH2:2]([CH3:3])[CH:4]1[CH:5]=[N:6][N:7]([C:9](=[NH:10])[NH:11][CH2:12][CH3:13])[CH2:8]1.[CH:14]([N:15]([CH2:16][CH3:17])[CH:18]([CH3:19])[CH3:20])([CH3:21])[CH3:22].[Cl:36][CH2:37][Cl:38].[ClH:1].[n:23]1[c:24]2[c:25]([n:26][s:27]1)[c:28]([S:32](=[O:33])(=[O:34])[Cl:35])[cH:29][cH:30][cH:31]2>>[CH2:2]([CH3:3])[CH:4]1[CH:5]=[N:6][N:7]([C:9](=[N:10][S:32]([c:28]2[c:25]3[c:24]([n:23][s:27][n:26]3)[cH:31][cH:30][cH:29]2)(=[O:33])=[O:34])[NH:11][CH2:12][CH3:13])[CH2:8]1

Participants

Reactant 5

HCID 313Hydrochloric Acid

HCID 6344Dichloromethane

HCID 81531Diisopropylethylamine

HCID 27354592,1,3-Benzothiadiazole, 4-chlorosulfonyl-

HCID 178464602HCID 178464602, compound

Product 1

HCID 178464644HCID 178464644, compound

Sources & evidence

ORD record: ord-11083825f4b642a18cb4f56afa25e54c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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