Toluene → HCID 67040940, 화합물

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[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[Cl:1][C:2]([CH2:3][O:4][C:5]([NH:6][c:7]1[cH:8][cH:9][c:10]([S:13][c:14]2[c:15]([N+:23](=[O:24])[O-:25])[cH:16][c:17]([C:20](=[O:21])[Cl:22])[cH:18][cH:19]2)[cH:11][cH:12]1)=[O:26])([Cl:27])[Cl:28].[s:29]1[c:30]([NH2:34])[n:31][n:32][cH:33]1>>[Cl:1][C:2]([CH2:3][O:4][C:5]([NH:6][c:7]1[cH:8][cH:9][c:10]([S:13][c:14]2[c:15]([N+:23](=[O:24])[O-:25])[cH:16][c:17]([C:20](=[O:21])[NH:34][c:30]3[s:29][cH:33][n:32][n:31]3)[cH:18][cH:19]2)[cH:11][cH:12]1)=[O:26])([Cl:27])[Cl:28]

참가 물질

반응물 3

HCID 1140Toluene

HCID 199091,3,4-Thiadiazol-2-amine

HCID 86615557HCID 86615557, 화합물

생성물 1

HCID 67040940HCID 67040940, 화합물

출처 및 근거

ORD 기록: ord-05390d61077d455f8c759dab5bd1c754
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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