Hydrochloric Acid → HCID 178440045, compound

HRID 2129927Notes

Reaction equation

[ClH:62].[Na+:56].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[OH-:55].[c:1]1([C:7]([CH3:8])=[C:9]2[C:10](=[O:54])[N:11]([CH2:17][c:18]3[cH:19][cH:20][c:21](-[c:24]4[c:25](-[c:30]5[n:31][n:32][n:33][n:34]5[C:35]([c:36]5[cH:37][cH:38][cH:39][cH:40][cH:41]5)([c:42]5[cH:43][cH:44][cH:45][cH:46][cH:47]5)[c:48]5[cH:49][cH:50][cH:51][cH:52][cH:53]5)[cH:26][cH:27][cH:28][cH:29]4)[cH:22][cH:23]3)[C:12]([CH2:14][CH2:15][CH3:16])=[N:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]([CH3:8])=[C:9]2[C:10](=[O:54])[N:11]([CH2:17][c:18]3[cH:19][cH:20][c:21](-[c:24]4[c:25](-[c:30]5[n:31][n:32][n:33][nH:34]5)[cH:26][cH:27][cH:28][cH:29]4)[cH:22][cH:23]3)[C:12]([CH2:14][CH2:15][CH3:16])=[N:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

Reactant 5

HCID 313Hydrochloric Acid

HCID 923Sodium ion

HCID 961Hydroxide

HCID 8028Tetrahydrofuran

HCID 678057693,5-dihydro-5-(1-phenylethylidene)-2-propyl-3-[(2'-(triphenylmethyltetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl]-4H-imidazol-4-one

Product 1

HCID 178440045HCID 178440045, compound

Sources & evidence

ORD record: ord-29b27b4fc7ce4e5f9a254272af6abf29
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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