Ethanol → 3-Piperazin-1-ylmethyl-pyrimido[5,4-e][1,2,4]triazine-5,7-diamine

반응식

[CH2:15]1[CH2:16][NH:17][CH2:18][CH2:19][NH:20]1.[CH3:21][CH2:22][OH:23].[Cl:1][CH2:2][c:3]1[n:4][n:5][c:6]2[c:7]([n:8]1)[c:9]([NH2:14])[n:10][c:11]([NH2:13])[n:12]2>>[CH2:2]([c:3]1[n:4][n:5][c:6]2[c:7]([n:8]1)[c:9]([NH2:14])[n:10][c:11]([NH2:13])[n:12]2)[N:17]1[CH2:16][CH2:15][NH:20][CH2:19][CH2:18]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 4837Piperazine

HCID 11390207HCID 11390207, 화합물

생성물 1

HCID 121095363-Piperazin-1-ylmethyl-pyrimido[5,4-e][1,2,4]triazine-5,7-diamine

출처 및 근거

ORD 기록: ord-1427246a50cf4956b5eae7b175db6d81
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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