Methanol → 3-Amino-4-[4-(4-piperidinomethylpyrazol-1-yloxy)-butylamino]-cyclobutene-1,2-dione

반응식

[CH3:28][OH:29].[N:1]1([CH2:7][c:8]2[cH:9][n:10][n:11]([O:13][CH2:14][CH2:15][CH2:16][CH2:17][NH2:18])[cH:12]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[NH2:19][c:20]1[c:21](=[O:27])[c:22](=[O:26])[c:23]1[O:24][CH3:25]>>[N:1]1([CH2:7][c:8]2[cH:9][n:10][n:11]([O:13][CH2:14][CH2:15][CH2:16][CH2:17][NH:18][c:23]3[c:20]([NH2:19])[c:21](=[O:27])[c:22]3=[O:26])[cH:12]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

참가 물질

반응물 3

HCID 887Methanol

HCID 134522053-Amino-4-methoxycyclobut-3-ene-1,2-dione

HCID 200307904-(4-Piperidinomethylpyrazol-1-yloxy)butylamine

생성물 1

HCID 138232173-Amino-4-[4-(4-piperidinomethylpyrazol-1-yloxy)-butylamino]-cyclobutene-1,2-dione

출처 및 근거

ORD 기록: ord-69f54714ad5448258a5e45d078fcd43e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…