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Methyl 3-[1-(2-chloro-3-hydroxyphenyl)ethoxy]-5-(6-cyanobenzimidazol-1-yl)thiophene-2-carboxylate → Methyl 3-[1-(2-chloro-3-hydroxyphenyl)ethoxy]-5-[5-(5-methyl-1,3,4-oxadiazol-2-yl)benzimidazol-1-yl]thiophene-2-carboxylate

HRID 1540425
노트
인쇄 미리보기

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HRID 1540425 반응식
[Cl:1][c:2]1[c:3]([CH:16]([CH3:17])[O:18][c:19]2[c:20]([C:39](=[O:40])[O:41][CH3:42])[s:21][c:22](-[n:24]3[cH:25][n:26][c:27]4[c:28]3[cH:29][cH:30][c:31](-[c:33]3[o:34][c:35]([CH3:38])[n:36][n:37]3)[cH:32]4)[cH:23]2)[cH:4][cH:5][cH:6][c:7]1[O:8][Si:9]([C:10]([CH3:11])([CH3:12])[CH3:13])([CH3:14])[CH3:15].[Cl:43][c:44]1[c:45]([OH:46])[cH:47][cH:48][cH:49][c:50]1[CH:51]([O:52][c:53]1[cH:54][c:55](-[n:56]2[c:57]3[cH:58][c:59]([C:60]#[N:61])[cH:62][cH:63][c:64]3[n:65][cH:66]2)[s:67][c:68]1[C:69]([O:70][CH3:71])=[O:72])[CH3:73]>>[Cl:1][c:2]1[c:3]([CH:16]([CH3:17])[O:18][c:19]2[c:20]([C:39](=[O:40])[O:41][CH3:42])[s:21][c:22](-[n:24]3[cH:25][n:26][c:27]4[c:28]3[cH:29][cH:30][c:31](-[c:33]3[o:34][c:35]([CH3:38])[n:36][n:37]3)[cH:32]4)[cH:23]2)[cH:4][cH:5][cH:6][c:7]1[OH:8]
참가 물질출처 및 근거반응 노트

참가 물질

3

반응물 2

HCID 57937453Methyl 3-[1-(2-chloro-3-hydroxyphenyl)ethoxy]-5-(6-cyanobenzimidazol-1-yl)thiophene-2-carboxylateHCID 57937469Methyl 3-[1-[3-[tert-butyl(dimethyl)silyl]oxy-2-chlorophenyl]ethoxy]-5-[5-(5-methyl-1,3,4-oxadiazol-2-yl)benzimidazol-1-yl]thiophene-2-carboxylate

생성물 1

HCID 57937474Methyl 3-[1-(2-chloro-3-hydroxyphenyl)ethoxy]-5-[5-(5-methyl-1,3,4-oxadiazol-2-yl)benzimidazol-1-yl]thiophene-2-carboxylate

출처 및 근거

ORD 기록
ord-06df967b4075458fb7c29239fee9b964
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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