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2-(Benzo[1,2,5]thiadiazole-4-sulfonylamino)-4-iodo-benzoic acid → 2-[[2-(2,1,3-Benzothiadiazol-4-ylsulfonylamino)-4-iodobenzoyl]amino]-3,3-bis(4-chlorophenyl)propanoic acid

HRID 1148236
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인쇄 미리보기

반응식

HRID 1148236 반응식
[CH3:1][O:2][C:3]([CH:4]([CH:5]([c:6]1[cH:7][cH:8][c:9]([Cl:12])[cH:10][cH:11]1)[c:13]1[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]1)[NH:20][C:21]([c:22]1[c:23]([NH:29][S:30](=[O:31])(=[O:32])[c:33]2[cH:34][cH:35][cH:36][c:37]3[c:38]2[n:39][s:40][n:41]3)[cH:24][c:25]([I:28])[cH:26][cH:27]1)=[O:42])=[O:43].[CH3:67][O:68][C:69](=[O:70])[CH:71]([NH2:72])[CH:73]([c:74]1[cH:75][cH:76][c:77]([Cl:78])[cH:79][cH:80]1)[c:81]1[cH:82][cH:83][c:84]([Cl:85])[cH:86][cH:87]1.[n:44]1[s:45][n:46][c:47]2[c:48]([S:49]([NH:50][c:51]3[cH:52][c:53]([I:54])[cH:55][cH:56][c:57]3[C:58]([OH:59])=[O:60])(=[O:61])=[O:62])[cH:63][cH:64][cH:65][c:66]12>>[O:2]=[C:3]([CH:4]([CH:5]([c:6]1[cH:7][cH:8][c:9]([Cl:12])[cH:10][cH:11]1)[c:13]1[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]1)[NH:20][C:21]([c:22]1[c:23]([NH:29][S:30](=[O:31])(=[O:32])[c:33]2[cH:34][cH:35][cH:36][c:37]3[c:38]2[n:39][s:40][n:41]3)[cH:24][c:25]([I:28])[cH:26][cH:27]1)=[O:42])[OH:43]
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참가 물질

4

반응물 3

HCID 160906642-(Benzo[1,2,5]thiadiazole-4-sulfonylamino)-4-iodo-benzoic acidHCID 68769907Methyl 2-amino-3,3-bis(4-chlorophenyl)propanoateHCID 178501640HCID 178501640, 화합물

생성물 1

HCID 687700142-[[2-(2,1,3-Benzothiadiazol-4-ylsulfonylamino)-4-iodobenzoyl]amino]-3,3-bis(4-chlorophenyl)propanoic acid

출처 및 근거

ORD 기록
ord-a6213906a6a84884affc9353c28080b4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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