2-Methanesulfonylacetic acid → N-{2-[3-(2-Cyclopentanecarbonyl-4-methyl-phenyl)-ureido]-thiazol-4-ylmethyl}-2-methanesulfonyl-acetamide
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[CH3:26][S:27](=[O:28])(=[O:29])[CH2:30][C:31](=[O:32])[OH:33].[NH2:1][CH2:2][c:3]1[n:4][c:5]([NH:8][C:9](=[O:10])[NH:11][c:12]2[c:13]([C:19](=[O:20])[CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25]3)[cH:14][c:15]([CH3:18])[cH:16][cH:17]2)[s:6][cH:7]1>>[NH:1]([CH2:2][c:3]1[n:4][c:5]([NH:8][C:9](=[O:10])[NH:11][c:12]2[c:13]([C:19](=[O:20])[CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25]3)[cH:14][c:15]([CH3:18])[cH:16][cH:17]2)[s:6][cH:7]1)[C:31]([CH2:30][S:27]([CH3:26])(=[O:28])=[O:29])=[O:32]참가 물질
3
출처 및 근거
- ORD 기록
- ord-8bfc3734e10d4460a12e263212cadf59
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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