Bicarbonate Ion → 2-Anilino-4-chloro-5-nitrothiazole
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[C:1](=[O:2])([O-:3])[OH:4].[CH3:23][C:24]#[N:25].[Cl:6][c:7]1[s:8][c:9]([N+:13](=[O:14])[O-:15])[c:10]([Cl:12])[n:11]1.[NH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[Na+:5]>>[c:7]1([NH:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[s:8][c:9]([N+:13](=[O:14])[O-:15])[c:10]([Cl:12])[n:11]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-de25bddbdc444e30872be37477fe42f4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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