Hydrochloric Acid → HCID 86601931, compound

HRID 89999Notes

Reaction equation

[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][c:11]2[n:12][c:13]3[c:14]([n:15]2[CH2:16][CH2:17][CH:18]2[O:19][CH2:22][CH2:21][O:20]2)[cH:23][c:24]([C:27](=[O:28])[N:29]([CH2:30][CH2:31][CH:32]([CH3:33])[CH3:34])[CH2:35][CH2:36][CH:37]([CH3:38])[CH3:39])[cH:25][cH:26]3)[cH:8][cH:9]1.[ClH:40].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][c:11]2[n:12][c:13]3[c:14]([n:15]2[CH2:16][CH2:17][CH:18]=[O:19])[cH:23][c:24]([C:27](=[O:28])[N:29]([CH2:30][CH2:31][CH:32]([CH3:33])[CH3:34])[CH2:35][CH2:36][CH:37]([CH3:38])[CH3:39])[cH:25][cH:26]3)[cH:8][cH:9]1

Participants

Reactant 3

HCID 313Hydrochloric Acid

HCID 8028Tetrahydrofuran

HCID 687918172-[(4-acetylphenyl)amino]-1-[2-(1,3-dioxolan-2-yl)ethyl]-N,N-bis(3-methylbutyl)-1H-benzimidazole-6-carboxamide

Product 1

HCID 86601931HCID 86601931, compound

Sources & evidence

ORD record: ord-8ec953bd694d4bf1ad839358d8faa9df
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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