4-Amino-5-chloro-2-methoxybenzoic acid → 4-amino-N-(1-(4-(N-benzoyl-N-methylamino)butyl)pyrrolidin-3-ylmethyl)-5-chloro-2-methoxybenzamide

HRID 90761

반응식

HRID 90761 반응식
[C:1]([O:2][C:6](=[O:7])[NH:8][CH2:9][CH:10]1[CH2:11][N:12]([CH2:15][CH2:16][CH2:17][CH2:18][N:19]([C:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)=[O:27])[CH3:28])[CH2:13][CH2:14]1)([CH3:3])([CH3:4])[CH3:5].[NH2:29][c:30]1[cH:31][c:32]([O:40][CH3:41])[c:33]([C:34]([OH:35])=[O:36])[cH:37][c:38]1[Cl:39]>>[C:6](=[O:7])([NH:8][CH2:9][CH:10]1[CH2:11][N:12]([CH2:15][CH2:16][CH2:17][CH2:18][N:19]([C:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)=[O:27])[CH3:28])[CH2:13][CH2:14]1)[c:33]1[c:32]([O:40][CH3:41])[cH:31][c:30]([NH2:29])[c:38]([Cl:39])[cH:37]1

참가 물질

3

반응물 2

HCID 816264-Amino-5-chloro-2-methoxybenzoic acidHCID 53789127N-(4-(3-tert-Butoxycarbonylaminomethylpyrrolidin-1-yl)butyl)-N-methylbenzamide

생성물 1

HCID 538413734-amino-N-(1-(4-(N-benzoyl-N-methylamino)butyl)pyrrolidin-3-ylmethyl)-5-chloro-2-methoxybenzamide

출처 및 근거

ORD 기록
ord-0b51a6cf28f344dcbacea1398dd55488
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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