Tetrahydrofuran → 3,5-diamino-N-[2-[(2-aminoethyl)propylamino]ethyl]-6-chloropyrazinecarboxamide

반응식

[NH2:17][CH2:18][CH2:19][N:20]([CH2:21][CH2:22][NH2:23])[CH2:24][CH2:25][CH3:26].[NH2:1][c:2]1[c:3]([C:10](=[O:11])[n:12]2[cH:13][cH:14][n:15][cH:16]2)[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1.[O:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1>>[NH2:1][c:2]1[c:3]([C:10](=[O:11])[NH:17][CH2:18][CH2:19][N:20]([CH2:21][CH2:22][NH2:23])[CH2:24][CH2:25][CH3:26])[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 13020010(3,5-diamino-6-chloropyrazin-2-yl)(1H-imidazol-1-yl)methanone

HCID 14122862N-(2-aminoethyl)-N-propyl-1,2-ethanediamine

생성물 1

HCID 542301853,5-diamino-N-[2-[(2-aminoethyl)propylamino]ethyl]-6-chloropyrazinecarboxamide

출처 및 근거

ORD 기록: ord-d2a13e3163e64eb8837da6139661d3ee
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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