HCID 22314151, 화합물 → Allyl-{1,1-dimethyl-3-[3-(4-trifluoromethyl-phenyl)-benzo[d]isothiazol-6-yl]-prop-2-ynyl}-methyl-amine

반응식

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

참가 물질

반응물 2

HCID 22314151HCID 22314151, 화합물

HCID 57428077Trifluoro-methanesulfonic acid 3-(4-trifluoromethyl-phenyl)-benzo[d]isothiazol-6-yl ester

생성물 1

HCID 69289166Allyl-{1,1-dimethyl-3-[3-(4-trifluoromethyl-phenyl)-benzo[d]isothiazol-6-yl]-prop-2-ynyl}-methyl-amine

출처 및 근거

ORD 기록: ord-de205bb8b411451bb3d6a8f7d3d78baf
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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