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Acetonitrile → Methyl 6-(1-(benzo[d]thiazol-2-ylcarbamoyl)-1,2,3,4-tetrahydroquinolin-7-yl)-3-phenylpicolinate

HRID 292928
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HRID 292928 반응식
[CH3:49][C:50]#[N:51].[c:1]1(-[c:7]2[c:8]([C:23](=[O:24])[O:25][CH3:26])[n:9][c:10](-[c:13]3[cH:14][cH:15][c:16]4[c:21]([cH:22]3)[NH:20][CH2:19][CH2:18][CH2:17]4)[cH:11][cH:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[s:27]1[c:28]([NH:36][C:37]([O:38][c:40]2[cH:41][cH:42][c:43]([N+:44]([O-:45])=[O:46])[cH:47][cH:48]2)=[O:39])[n:29][c:30]2[c:31]1[cH:32][cH:33][cH:34][cH:35]2>>[c:1]1(-[c:7]2[c:8]([C:23](=[O:24])[O:25][CH3:26])[n:9][c:10](-[c:13]3[cH:14][cH:15][c:16]4[c:21]([cH:22]3)[N:20]([C:37]([NH:36][c:28]3[s:27][c:31]5[c:30]([n:29]3)[cH:35][cH:34][cH:33][cH:32]5)=[O:38])[CH2:19][CH2:18][CH2:17]4)[cH:11][cH:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1
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반응물 3

HCID 6342AcetonitrileHCID 594186764-Nitrophenyl benzo[d]thiazol-2-ylcarbamateHCID 59418700Methyl 3-phenyl-6-(1,2,3,4-tetrahydroquinolin-7-yl)picolinate

생성물 1

HCID 59418756Methyl 6-(1-(benzo[d]thiazol-2-ylcarbamoyl)-1,2,3,4-tetrahydroquinolin-7-yl)-3-phenylpicolinate

출처 및 근거

ORD 기록
ord-187c5655a9334aa991405ee9430c0376
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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