Hydrochloric Acid → (RS)-7-[(Pyrid-3-yl)imino]-4,4a,5,9-tetrahydrothiazolo[3,4-a]thieno[3,2-d]pyridine

HRID 134215Notes

Reaction equation

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

Participants

Reactant 4

HCID 313Hydrochloric Acid

HCID 3776Isopropanol

HCID 7914Diisopropyl Ether

HCID 12939921(RS)-5-hydroxymethyl-6-[(pyrid-3-yl)thiocarbamoyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine

Product 1

HCID 12939925(RS)-7-[(Pyrid-3-yl)imino]-4,4a,5,9-tetrahydrothiazolo[3,4-a]thieno[3,2-d]pyridine

Sources & evidence

ORD record: ord-d0b3589ec06a4d26886ca142b9133cf1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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