Methanol → Bicalutamide

반응식

[C:1](#[N:2])[c:3]1[c:4]([C:24]([F:25])([F:26])[F:27])[cH:5][c:6]([NH:9][C:10]([C:11]([CH2:12][S:13][c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)([CH3:21])[OH:22])=[O:23])[cH:7][cH:8]1.[CH3:29][OH:30].[OH2:28]>>[C:1](#[N:2])[c:3]1[c:4]([C:24]([F:25])([F:26])[F:27])[cH:5][c:6]([NH:9][C:10]([C:11]([CH2:12][S:13]([c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)(=[O:28])=[O:30])([CH3:21])[OH:22])=[O:23])[cH:7][cH:8]1

참가 물질

반응물 3

HCID 887Methanol

HCID 962Water

HCID 9800987Bicalutamide sulfide

생성물 1

HCID 2375Bicalutamide

출처 및 근거

ORD 기록: ord-f6d8085fb68b4a00b6a36f94c1dae4b4
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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