3-Methyl-2-butenoyl chloride → HCID 86591730, 화합물

HRID 671882노트

반응식

HRID 671882 반응식
[CH3:26][C:27](=[CH:28][C:29](=[O:30])[Cl:31])[CH3:32].[s:1]1[n:2][c:3]([N:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][c:18]3[c:19]([NH2:25])[cH:20][cH:21][c:22]([F:24])[cH:23]3)[CH2:14][CH2:15]2)[c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[s:1]1[n:2][c:3]([N:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][c:18]3[c:19]([NH:25][C:29]([CH:28]=[C:27]([CH3:26])[CH3:32])=[O:30])[cH:20][cH:21][c:22]([F:24])[cH:23]3)[CH2:14][CH2:15]2)[c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2

참가 물질

3

반응물 2

HCID 1023943-Methyl-2-butenoyl chlorideHCID 219632182-[2-(4-1,2-Benzisothiazol-3-yl-piperazin-1-yl)-ethyl]-4-fluoro-phenylamine

생성물 1

HCID 86591730HCID 86591730, 화합물

출처 및 근거

ORD 기록
ord-150a9ba93898483f8d7bd89117a13a89
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

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