Hydrochloric Acid → Hydrochloric Acid

HRID 179807Notes

Reaction equation

HRID 179807 reaction equation
[Cl:39][CH2:40][Cl:41].[ClH:38].[NH:1]([NH:2][C:3]([O:4][C:5]([CH3:6])([CH3:7])[CH3:8])=[O:9])[C:10](=[O:11])[O:12][CH2:13][c:14]1[c:15]([F:31])[cH:16][c:17]([CH2:20][CH2:21][c:22]2[n:23][c:24]([NH:27][C:28]([CH3:29])=[O:30])[s:25][cH:26]2)[cH:18][cH:19]1.[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1>>[ClH:38].[NH:1]([NH2:2])[C:10](=[O:11])[O:12][CH2:13][c:14]1[c:15]([F:31])[cH:16][c:17]([CH2:20][CH2:21][c:22]2[n:23][c:24]([NH:27][C:28]([CH3:29])=[O:30])[s:25][cH:26]2)[cH:18][cH:19]1

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 312751,4-DioxaneHCID 866499894-{2-[2-(Acetylamino)-1,3-thiazol-4-yl]ethyl}-2-fluorobenzyl tert-butyl hydrazine-1,2-dicarboxylate

Product 2

HCID 313Hydrochloric AcidHCID 44159727[4-[2-(2-acetamido-1,3-thiazol-4-yl)ethyl]-2-fluorophenyl]methyl N-aminocarbamate

Sources & evidence

ORD record
ord-2149230ea65f4a45bb9acc217acc694a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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