Chlorophenyl isocyanate → tert-Butyl tert-butyl(2-(2-chlorophenylcarbamoyl)-4,5-dihydropyrido[4,3-b]thieno[2,3-d]oxepin-8-yl)carbamate

반응식

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

참가 물질

반응물 2

HCID 76833Chlorophenyl isocyanate

HCID 57900354Tert-butyl 2-bromo-4,5-dihydropyrido[4,3-b]thieno[2,3-d]oxepin-8-yl(tert-butyl)carbamate

생성물 1

HCID 57900446tert-Butyl tert-butyl(2-(2-chlorophenylcarbamoyl)-4,5-dihydropyrido[4,3-b]thieno[2,3-d]oxepin-8-yl)carbamate

출처 및 근거

ORD 기록: ord-e4b97dd37a4d4f54841dd77fc26b4764
출처 데이터셋: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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