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Dichloromethane → [1-[4-[2-(4-Chlorophenyl)-7-oxothieno[2,3-d]pyridazin-6-yl]-2-methoxyphenoxy]-2-methylpropan-2-yl] 2-aminoacetate

HRID 2332563
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HRID 2332563 반응식
[C:1]([O:2][C:3](=[O:4])[NH:8][CH2:9][C:10](=[O:11])[O:12][C:13]([CH2:14][O:15][c:16]1[c:17]([O:39][CH3:40])[cH:18][c:19](-[n:22]2[n:23][cH:24][c:25]3[c:26]([c:27]2=[O:28])[s:29][c:30](-[c:32]2[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]2)[cH:31]3)[cH:20][cH:21]1)([CH3:41])[CH3:42])([CH3:5])([CH3:6])[CH3:7].[Cl:50][CH2:51][Cl:52].[OH:43][C:44]([C:45]([F:46])([F:47])[F:48])=[O:49]>>[NH2:8][CH2:9][C:10](=[O:11])[O:12][C:13]([CH2:14][O:15][c:16]1[c:17]([O:39][CH3:40])[cH:18][c:19](-[n:22]2[n:23][cH:24][c:25]3[c:26]([c:27]2=[O:28])[s:29][c:30](-[c:32]2[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]2)[cH:31]3)[cH:20][cH:21]1)([CH3:41])[CH3:42]
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반응물 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 251172741-(4-(2-(4-Chlorophenyl)-7-oxothieno[2,3-d]pyridazin-6(7H)-yl)-2-methoxyphenoxy)-2-methylpropan-2-yl 2-(tert-butoxycarbonylamino)acetate

생성물 1

HCID 58133464[1-[4-[2-(4-Chlorophenyl)-7-oxothieno[2,3-d]pyridazin-6-yl]-2-methoxyphenoxy]-2-methylpropan-2-yl] 2-aminoacetate

출처 및 근거

ORD 기록
ord-82d4119623164bc29d7cde0bd6227a87
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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