Ethyl 2-(2-aminothiazol-5-ylthio)acetate → {2-[3-Cycloheptyl-3-(trans-4-phenyl-cyclohexyl)-ureido]-thiazol-5-ylsulfanyl}-acetic acid
반응식
[CH2:48]([O:49][C:50](=[O:51])[CH2:52][S:53][c:54]1[s:55][c:56]([NH2:57])[n:58][cH:59]1)[CH3:60].[CH:1]1([N:2]([CH:3]2[CH2:4][CH2:5][CH:6]([CH2:20][CH3:21])[CH2:22][CH2:23]2)[C:7]([NH:8][c:9]2[s:10][c:11]([S:14][CH2:15][C:16](=[O:17])[OH:18])[cH:12][n:13]2)=[O:19])[CH2:24][CH2:25][CH2:26][CH2:27]1.[CH:28]1([NH:35][CH:36]2[CH2:37][CH2:38][CH:39]([c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[CH2:40][CH2:41]2)[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]1>>[C:7]([NH:8][c:9]1[s:10][c:11]([S:14][CH2:15][C:16](=[O:17])[OH:18])[cH:12][n:13]1)(=[O:19])[N:35]([CH:28]1[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]1)[CH:36]1[CH2:37][CH2:38][CH:39]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[CH2:40][CH2:41]1참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-72090f9979ec4d4a8817e8d1b59c85c5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)