Toluene → tert-Butyl 2-thioxo-1,4'-bipiperidin-1'-carboxylate

반응식

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

참가 물질

반응물 3

HCID 1140Toluene

HCID 87949Lawesson's reagent

HCID 66524582Tert-butyl 2-oxo-1,4'-bipiperidine-1'-carboxylate

생성물 1

HCID 86082829tert-Butyl 2-thioxo-1,4'-bipiperidin-1'-carboxylate

출처 및 근거

ORD 기록: ord-64e9ead14c984aae9b0487532b59acdc
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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