Hydrochloric Acid → Hydrochloric Acid

HRID 86395Notes

Reaction equation

HRID 86395 reaction equation
[CH3:1][n:2]1[n:3][cH:4][c:5]2[c:6]1[c:7]1[o:8][c:9](-[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:10](-[c:16]3[cH:17][cH:18][c:19]([C:22]4([NH:26][S:27]([C:28]([CH3:29])([CH3:30])[CH3:31])=[O:32])[CH2:23][CH2:24][CH2:25]4)[n:20][cH:21]3)[c:11](=[O:15])[c:12]1[cH:13][cH:14]2.[CH3:46][OH:47].[ClH:39].[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1>>[CH3:1][n:2]1[n:3][cH:4][c:5]2[c:6]1[c:7]1[o:8][c:9](-[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:10](-[c:16]3[cH:17][cH:18][c:19]([C:22]4([NH2:26])[CH2:23][CH2:24][CH2:25]4)[n:20][cH:21]3)[c:11](=[O:15])[c:12]1[cH:13][cH:14]2.[ClH:39]

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 670678412-Methyl-propane-2-sulfinic acid {1-[5-(1-methyl-6-oxo-8-phenyl-1,6-dihydro-9-oxa-1,2-diaza-cyclopenta[a]naphthalen-7-yl)-pyridin-2-yl]-cyclobutyl}-amide

Product 2

HCID 313Hydrochloric AcidHCID 51030134HCID 51030134, compound

Sources & evidence

ORD record
ord-f382fb72cb9c4f38b2cfae970c9220f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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