5-(2,4-dichlorophenyl)-N-(2-ethoxy-2,3-dihydro-1H-inden-1-yl)-3,6-diethylpyrazin-2-amine → 6-cyclopropyl-5-(2,4-dichlorophenyl)-N-(2-ethoxy-2,3-dihydro-1H-inden-1-yl)-3-ethylpyrazin-2-amine

반응식

[CH:32]1([c:33]2[n:34][c:35]([NH:36][CH:37]3[c:38]4[c:39]([cH:40][cH:41][cH:42][cH:43]4)[CH2:44][CH:45]3[OH:46])[c:47]([CH2:48][CH3:49])[n:50][c:51]2-[c:52]2[cH:53][cH:54][c:55]([Cl:56])[cH:57][c:58]2[Cl:59])[CH2:60][CH2:61]1.[Cl:1][c:2]1[c:3](-[c:9]2[n:10][c:11]([CH2:30][CH3:31])[c:12]([NH:17][CH:18]3[CH:19]([O:27][CH2:28][CH3:29])[CH2:20][c:21]4[cH:22][cH:23][cH:24][cH:25][c:26]43)[n:13][c:14]2[CH2:15][CH3:16])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10][c:11]([CH2:30][CH3:31])[c:12]([NH:17][CH:18]3[CH:19]([O:27][CH2:28][CH3:29])[CH2:20][c:21]4[cH:22][cH:23][cH:24][cH:25][c:26]43)[n:13][c:14]2[CH:15]2[CH2:16][CH2:32]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

참가 물질

반응물 2

HCID 221473105-(2,4-dichlorophenyl)-N-(2-ethoxy-2,3-dihydro-1H-inden-1-yl)-3,6-diethylpyrazin-2-amine

HCID 221475021-[[6-cyclopropyl-5-(2,4-dichlorophenyl)-3-ethylpyrazin-2-yl]amino]-2,3-dihydro-1H-inden-2-ol

생성물 1

HCID 221475286-cyclopropyl-5-(2,4-dichlorophenyl)-N-(2-ethoxy-2,3-dihydro-1H-inden-1-yl)-3-ethylpyrazin-2-amine

출처 및 근거

ORD 기록: ord-6e538d9e01c04eb18109e5c6acc05ed1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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