Water → HCID 20192932, 화합물

HRID 167485

반응식

HRID 167485 반응식
[C:18](=[O:19])([O:20][CH2:21][CH3:22])[N:23]1[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[s:6][c:7]2[c:8]([n:9]1)[cH:10][c:11]([Cl:17])[c:12]([N+:14](=[O:15])[O-:16])[cH:13]2.[OH2:29]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[s:6][c:7]2[c:8]([n:9]1)[cH:10][c:11]([N:26]1[CH2:25][CH2:24][N:23]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[CH2:28][CH2:27]1)[c:12]([N+:14](=[O:15])[O-:16])[cH:13]2

참가 물질

4

반응물 3

HCID 962WaterHCID 84311-Piperazinecarboxylic acid, ethyl esterHCID 197942022-Tert-butyl-5-chloro-6-nitrobenzothiazole

생성물 1

HCID 20192932HCID 20192932, 화합물

출처 및 근거

ORD 기록
ord-c630b597f8f84b26b7c15397c75fe119
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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