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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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3-Chloro-4,7-difluorobenzo[b]thiophene-2-carbonyl chloride → tert-Butyl (4-{(3-chloro-4,7-difluoro-benzo[b]thiophene-2-carbonyl)-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzyl]-amino}-cyclohexyl)-methyl-carbamate

HRID 313660
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HRID 313660 반응식
[CH3:1][c:2]1[n:3][c:4]([CH3:33])[cH:5][c:6](-[c:8]2[cH:9][cH:10][c:11]([O:31][CH3:32])[c:12]([CH2:13][NH:14][CH:15]3[CH2:16][CH2:17][CH:18]([N:21]([C:22]([O:23][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[CH3:29])[CH2:19][CH2:20]3)[cH:30]2)[cH:7]1.[Cl:34][c:35]1[c:36]2[c:37]([s:38][c:39]1[C:40](=[O:41])[Cl:42])[c:43]([F:48])[cH:44][cH:45][c:46]2[F:47]>>[CH3:1][c:2]1[n:3][c:4]([CH3:33])[cH:5][c:6](-[c:8]2[cH:9][cH:10][c:11]([O:31][CH3:32])[c:12]([CH2:13][N:14]([CH:15]3[CH2:16][CH2:17][CH:18]([N:21]([C:22]([O:23][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[CH3:29])[CH2:19][CH2:20]3)[C:40]([c:39]3[c:35]([Cl:34])[c:36]4[c:37]([s:38]3)[c:43]([F:48])[cH:44][cH:45][c:46]4[F:47])=[O:41])[cH:30]2)[cH:7]1
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반응물 2

HCID 219384153-Chloro-4,7-difluorobenzo[b]thiophene-2-carbonyl chlorideHCID 59683595tert-Butyl {4-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzylamino]-cyclohexyl}-methyl-carbamate

생성물 1

HCID 59683506tert-Butyl (4-{(3-chloro-4,7-difluoro-benzo[b]thiophene-2-carbonyl)-[5-(2,6-dimethyl-pyridin-4-yl)-2-methoxy-benzyl]-amino}-cyclohexyl)-methyl-carbamate

출처 및 근거

ORD 기록
ord-69d89b75c32c4c0d92e36b566a72dee8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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