[2-(4-Cyanophenylimino)-2-(4-fluoro-7-methoxy-2,3-dihydrobenzofuran-5-yl)-1-methylsulfanylethylidene]carbamic acid methyl ester → HCID 135982182, compound
Reaction equation
[C:1]([NH2:2])(=[NH:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][CH:11]([c:12]2[n:13][n:14](-[c:18]3[c:19]([C:23](=[O:24])[OH:25])[s:20][cH:21][cH:22]3)[c:15](=[O:17])[nH:16]2)[c:26]2[c:27]([F:38])[c:28]3[c:29]([c:34]([O:36][CH3:37])[cH:35]2)[O:30][CH2:31][CH2:32][O:33]3)[cH:8][cH:9]1.[CH3:39][O:40][C:41](=[O:42])[N:43]=[C:44]([S:45][CH3:46])[C:47](=[N:48][c:49]1[cH:50][cH:51][c:52]([C:53]#[N:54])[cH:55][cH:56]1)[c:57]1[cH:58][c:59]([O:60][CH3:61])[c:62]2[c:66]([c:67]1[F:68])[CH2:65][CH2:64][O:63]2>>[C:1]([NH2:2])(=[NH:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][CH:11]([c:12]2[n:13][n:14](-[c:18]3[c:19]([C:23](=[O:24])[OH:25])[s:20][cH:21][cH:22]3)[c:15](=[O:17])[nH:16]2)[c:26]2[c:27]([F:38])[c:28]3[c:29]([c:34]([O:36][CH3:37])[cH:35]2)[O:30][CH2:31][CH2:32]3)[cH:8][cH:9]1Participants
3
Sources & evidence
- ORD record
- ord-9d9f7fa1d2604f3d9295885fe4d5d89a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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