Hydrochloric Acid → Methyl 1-({5-[5-(3-chloro-4-phenoxyphenyl)-1,2,4-oxadiazol-3-yl]-4-ethyl-2-thienyl}methyl)azetidine-3-carboxylate

HRID 295023Notes

Reaction equation

HRID 295023 reaction equation
[C:29]([Br:30])([Br:31])([Br:32])[Br:33].[CH:62]([N:63]([CH2:64][CH3:65])[CH:66]([CH3:67])[CH3:68])([CH3:69])[CH3:70].[Cl:1][c:2]1[cH:3][c:4](-[c:15]2[n:16][c:17](-[c:20]3[c:21]([CH2:27][CH3:28])[cH:22][c:23]([CH2:25][OH:26])[s:24]3)[n:18][o:19]2)[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1.[ClH:53].[NH:54]1[CH2:55][CH:56]([C:58](=[O:59])[O:60][CH3:61])[CH2:57]1.[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[Cl:1][c:2]1[cH:3][c:4](-[c:15]2[n:16][c:17](-[c:20]3[c:21]([CH2:27][CH3:28])[cH:22][c:23]([CH2:25][N:54]4[CH2:55][CH:56]([C:58](=[O:59])[O:60][CH3:61])[CH2:57]4)[s:24]3)[n:18][o:19]2)[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 11205Carbon tetrabromideHCID 11776TriphenylphosphineHCID 81531DiisopropylethylamineHCID 20132751Methyl azetidine-3-carboxylateHCID 68525760{5-[5-(3-Chloro-4-phenoxyphenyl)-1,2,4-oxadiazol-3-yl]-4-ethyl-2-thienyl}methanol

Product 1

HCID 68525794Methyl 1-({5-[5-(3-chloro-4-phenoxyphenyl)-1,2,4-oxadiazol-3-yl]-4-ethyl-2-thienyl}methyl)azetidine-3-carboxylate

Sources & evidence

ORD record
ord-5f3713a38fec400bb6d3105fe567ebf8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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