Water → Ziprasidone

반응식

[Cl:1][CH2:2][CH2:3][c:4]1[cH:5][c:6]2[c:10]([cH:11][c:12]1[Cl:13])[NH:9][C:8](=[O:14])[CH2:7]2.[OH2:30].[s:15]1[n:16][c:17]([N:24]2[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]2)[c:18]2[c:19]1[cH:20][cH:21][cH:22][cH:23]2>>[CH2:2]([CH2:3][c:4]1[cH:5][c:6]2[c:10]([cH:11][c:12]1[Cl:13])[NH:9][C:8](=[O:14])[CH2:7]2)[N:27]1[CH2:26][CH2:25][N:24]([c:17]2[n:16][s:15][c:19]3[c:18]2[cH:23][cH:22][cH:21][cH:20]3)[CH2:29][CH2:28]1

참가 물질

반응물 3

HCID 962Water

HCID 27721443-(1-Piperazinyl)-1,2-benzisothiazole

HCID 106094745-(2-Chloroethyl)-6-chlorooxindole

생성물 1

HCID 60854Ziprasidone

출처 및 근거

ORD 기록: ord-c10c6683d68847d1bab5a92913e5cd21
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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