2-Chloro-4-(methylsulfonyl)benzoic acid → Vismodegib

HRID 157921

반응식

HRID 157921 반응식
[Cl:15][c:16]1[c:17]([C:18](=[O:19])[OH:20])[cH:21][cH:22][c:23]([S:25](=[O:26])(=[O:27])[CH3:28])[cH:24]1.[Cl:1][c:2]1[c:3](-[c:9]2[n:10][cH:11][cH:12][cH:13][cH:14]2)[cH:4][c:5]([NH2:6])[cH:7][cH:8]1>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10][cH:11][cH:12][cH:13][cH:14]2)[cH:4][c:5]([NH:6][C:18]([c:17]2[c:16]([Cl:15])[cH:24][c:23]([S:25](=[O:26])(=[O:27])[CH3:28])[cH:22][cH:21]2)=[O:19])[cH:7][cH:8]1

참가 물질

3

반응물 2

HCID 7358632-Chloro-4-(methylsulfonyl)benzoic acidHCID 401519254-Chloro-3-(pyridin-2-yl)aniline

생성물 1

HCID 24776445Vismodegib

출처 및 근거

ORD 기록
ord-07078e1b1cd64e2e92e044abc51a504c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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