Tetrahydrofuran → N-(1,1,3-trimethyl-4-indanyl)-2-methyl-4-trifluoromethylthiazole-5-carbothioamide

반응식

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

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 45209581,3,2,4-Dithiadiphosphetane, 2,4-bis(methylthio)-, 2,4-disulfide

HCID 14535764N-(1,1,3-trimethyl-4-indanyl)-2-methyl-4-trifluoromethylthiazole-5-carboxamide

생성물 1

HCID 14535765N-(1,1,3-trimethyl-4-indanyl)-2-methyl-4-trifluoromethylthiazole-5-carbothioamide

출처 및 근거

ORD 기록: ord-f287b9cbdec24731a9f2ab7e33daf992
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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