Hydrochloric Acid → ethyl ({[2-[6-ethyl-2,4-dioxo-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-1,4-dihydrothieno[2,3-d]pyrimidin-3(2H)-yl]-1-(4-fluorophenyl)ethylidene]amino}oxy)acetate

HRID 166579

Reaction equation

HRID 166579 reaction equation
[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[c:6]([n:7]([CH2:23][c:24]3[cH:25][cH:26][c:27](-[c:30]4[c:31](-[c:36]5[n:37][o:38][c:39](=[O:41])[nH:40]5)[cH:32][cH:33][cH:34][cH:35]4)[cH:28][cH:29]3)[c:8](=[O:22])[n:9]([CH2:12][C:13](=[O:14])[c:15]3[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]3)[c:10]2=[O:11])[s:42]1.[CH3:64][CH2:65][OH:66].[CH:60]([Cl:61])([Cl:62])[Cl:63].[ClH:43].[ClH:58].[NH2:44][O:45][CH2:46][C:47](=[O:48])[O:49][CH2:50][CH3:51].[OH2:59].[cH:52]1[cH:53][cH:54][n:55][cH:56][cH:57]1>>[CH2:1]([CH3:2])[c:3]1[cH:4][c:5]2[c:6]([n:7]([CH2:23][c:24]3[cH:25][cH:26][c:27](-[c:30]4[c:31](-[c:36]5[n:37][o:38][c:39](=[O:41])[nH:40]5)[cH:32][cH:33][cH:34][cH:35]4)[cH:28][cH:29]3)[c:8](=[O:22])[n:9]([CH2:12][C:13]([c:15]3[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]3)=[N:44][O:45][CH2:46][C:47](=[O:48])[O:49][CH2:50][CH3:51])[c:10]2=[O:11])[s:42]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 702EthanolHCID 962WaterHCID 1049PyridineHCID 6212ChloroformHCID 198082-Aminoxy-acetic acid ethyl esterHCID 1360523186-ethyl-3-[2-(4-fluorophenyl)-2-oxoethyl]-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione

Product 1

HCID 136052311ethyl ({[2-[6-ethyl-2,4-dioxo-1-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-1,4-dihydrothieno[2,3-d]pyrimidin-3(2H)-yl]-1-(4-fluorophenyl)ethylidene]amino}oxy)acetate

Sources & evidence

ORD record
ord-fceabcccfe2540cb9cafced5084f70c2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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