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Pyridine → 3-(1-cyanocyclopropyl)-N-[5-({2-[(cyclopropylcarbonyl)amino][1,3]thiazolo[5,4-b]pyridin-5-yl}oxy)-2-methylphenyl]benzamide

HRID 110701
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반응식

HRID 110701 반응식
[CH:33]1([C:36](=[O:37])[Cl:38])[CH2:34][CH2:35]1.[NH2:1][c:2]1[s:3][c:4]2[n:5][c:6]([O:11][c:12]3[cH:13][cH:14][c:15]([CH3:32])[c:16]([NH:18][C:19]([c:20]4[cH:21][c:22]([C:26]5([C:29]#[N:30])[CH2:27][CH2:28]5)[cH:23][cH:24][cH:25]4)=[O:31])[cH:17]3)[cH:7][cH:8][c:9]2[n:10]1.[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[NH:1]([c:2]1[s:3][c:4]2[n:5][c:6]([O:11][c:12]3[cH:13][cH:14][c:15]([CH3:32])[c:16]([NH:18][C:19]([c:20]4[cH:21][c:22]([C:26]5([C:29]#[N:30])[CH2:27][CH2:28]5)[cH:23][cH:24][cH:25]4)=[O:31])[cH:17]3)[cH:7][cH:8][c:9]2[n:10]1)[C:36]([CH:33]1[CH2:34][CH2:35]1)=[O:37]
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반응물 3

HCID 1049PyridineHCID 77637Cyclopropanecarbonyl chlorideHCID 86645998N-{5-[(2-amino[1,3]thiazolo[5,4-b]pyridin-5-yl)oxy]-2-methylphenyl)-3-(1-cyanocyclopropyl)benzamide

생성물 1

HCID 595070103-(1-cyanocyclopropyl)-N-[5-({2-[(cyclopropylcarbonyl)amino][1,3]thiazolo[5,4-b]pyridin-5-yl}oxy)-2-methylphenyl]benzamide

출처 및 근거

ORD 기록
ord-e487fec28c9e4f3f949a0a08f82e2c0a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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