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Hydrochloric Acid → 4-(4-{[(3-Cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)benzoic acid

HRID 1210868
Notes
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Reaction equation

HRID 1210868 reaction equation
[C:1](#[N:2])[c:3]1[c:4](-[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:5]2[c:6]([n:7][c:8]1[S:9][CH2:10][c:11]1[n:12][c:13](-[c:16]3[cH:17][cH:18][c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]3)[s:14][cH:15]1)[CH2:26][CH2:27][CH2:28]2.[ClH:37].[Na+:36].[O:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1.[OH-:35]>>[C:1](#[N:2])[c:3]1[c:4](-[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:5]2[c:6]([n:7][c:8]1[S:9][CH2:10][c:11]1[n:12][c:13](-[c:16]3[cH:17][cH:18][c:19]([C:20](=[O:21])[OH:22])[cH:24][cH:25]3)[s:14][cH:15]1)[CH2:26][CH2:27][CH2:28]2
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 312751,4-DioxaneHCID 44133054Methyl 4-(4-{[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)benzoate

Product 1

HCID 44132890
4-(4-{[(3-Cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)benzoic acid

Sources & evidence

ORD record
ord-eb5f9899a22a459491315c5011856ba5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes