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Acetonitrile → Tert-butyl 6-(4-(benzo[d]thiazol-2-ylcarbamoyl)-1-methyl-1,2,3,4-tetrahydroquinoxalin-6-yl)picolinate

HRID 1222556
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HRID 1222556 반응식
[CH3:1][N:2]1[CH2:3][CH2:4][NH:5][c:6]2[cH:7][c:8](-[c:12]3[cH:13][cH:14][cH:15][c:16]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[n:17]3)[cH:9][cH:10][c:11]21.[CH3:47][C:48]#[N:49].[s:25]1[c:26]([NH:34][C:35]([O:36][c:38]2[cH:39][cH:40][c:41]([N+:42]([O-:43])=[O:44])[cH:45][cH:46]2)=[O:37])[n:27][c:28]2[c:29]1[cH:30][cH:31][cH:32][cH:33]2>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([C:35]([NH:34][c:26]2[s:25][c:29]3[c:28]([n:27]2)[cH:33][cH:32][cH:31][cH:30]3)=[O:36])[c:6]2[cH:7][c:8](-[c:12]3[cH:13][cH:14][cH:15][c:16]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[n:17]3)[cH:9][cH:10][c:11]21
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반응물 3

HCID 6342AcetonitrileHCID 594186764-Nitrophenyl benzo[d]thiazol-2-ylcarbamateHCID 59418755Tert-butyl 6-(1-methyl-1,2,3,4-tetrahydroquinoxalin-6-yl)picolinate

생성물 1

HCID 59418667Tert-butyl 6-(4-(benzo[d]thiazol-2-ylcarbamoyl)-1-methyl-1,2,3,4-tetrahydroquinoxalin-6-yl)picolinate

출처 및 근거

ORD 기록
ord-e17cd2725dd24495bfb43f996bbc4f16
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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