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Acetic Acid → tert-Butyl 7-{2-[1-(2-amino-pyrimidin-4-yl)-ethylamino]-benzoylamino}-4,4-dimethyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

HRID 817925
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인쇄 미리보기

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HRID 817925 반응식
[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16](=[O:17])[N:18]1[CH2:19][c:20]2[cH:21][c:22]([NH:30][C:31]([c:32]3[c:33]([NH2:38])[cH:34][cH:35][cH:36][cH:37]3)=[O:39])[cH:23][cH:24][c:25]2[C:26]([CH3:28])([CH3:29])[CH2:27]1.[C:40]([OH:41])(=[O:42])[CH3:43].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:8]([CH3:9])=[O:10])[n:7]1>>[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6]([CH:8]([CH3:9])[NH:38][c:33]2[c:32]([C:31]([NH:30][c:22]3[cH:21][c:20]4[c:25]([cH:24][cH:23]3)[C:26]([CH3:28])([CH3:29])[CH2:27][N:18]([C:16]([O:15][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:17])[CH2:19]4)=[O:39])[cH:37][cH:36][cH:35][cH:34]2)[n:7]1
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참가 물질

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반응물 4

HCID 176Acetic AcidHCID 1140TolueneHCID 135822701-(2-Aminopyrimidin-4-yl)ethan-1-oneHCID 695107067-(2-amino-benzoylamino)-4,4-dimethyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester

생성물 1

HCID 59017468tert-Butyl 7-{2-[1-(2-amino-pyrimidin-4-yl)-ethylamino]-benzoylamino}-4,4-dimethyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

출처 및 근거

ORD 기록
ord-37f61a57d606402a8af25bf1349d611f
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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