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1,2-Dichloroethane → 2-oxo-3-tert-butoxycarbonylamino-5-(2-pyridylcarbonyl)-8-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine

HRID 1119710
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HRID 1119710 반응식
[Cl:38][CH2:39][CH2:40][Cl:41].[ClH:22].[O:1]=[C:2]1[CH:3]([NH:14][C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:4][NH:5][c:6]2[c:7]([cH:9][c:10]([CH3:13])[cH:11][cH:12]2)[NH:8]1.[c:23]1([C:29](=[O:30])[Cl:31])[cH:24][cH:25][cH:26][cH:27][n:28]1.[cH:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1>>[O:1]=[C:2]1[CH:3]([NH:14][C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:4][N:5]([C:29]([c:23]2[cH:24][cH:25][cH:26][cH:27][n:28]2)=[O:30])[c:6]2[c:7]([cH:9][c:10]([CH3:13])[cH:11][cH:12]2)[NH:8]1
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반응물 5

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 1049PyridineHCID 135034Pyridine-2-carbonyl chlorideHCID 212015812-oxo-3-tert-butoxycarbonylamino-8-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine

생성물 1

HCID 212017912-oxo-3-tert-butoxycarbonylamino-5-(2-pyridylcarbonyl)-8-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine
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출처 및 근거

ORD 기록
ord-f65d0e91dad14be19613fc1d6ce478bf
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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