p-Toluenesulfonate → 3-[3-Benzyl-5-(3-methyl-3H-benzothiazol-2-ylidene)-4-oxothiazolidin-2-ylideneamino]-4-ethylaminobenzoic Acid Methyl Ester
Reaction equation
[CH2:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[N:35]1[CH2+:36]([S:51][CH3:52])[S:37][C:38](=[C:41]2[S:42][c:43]3[c:44]([cH:47][cH:48][cH:49][cH:50]3)[N:45]2[CH3:46])[C:39]1=[O:40].[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([N+:13]([O-:14])=[O:15])[c:7]([NH:10][CH2:11][CH3:12])[cH:8][cH:9]1)=[O:16].[c:17]1([CH3:18])[cH:19][cH:20][c:21]([S:22]([O-:23])(=[O:24])=[O:25])[cH:26][cH:27]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([N:13]=[C:36]2[N:35]([CH2:28][c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[C:39](=[O:40])[C:38](=[C:41]3[S:42][c:43]4[c:44]([cH:47][cH:48][cH:49][cH:50]4)[N:45]3[CH3:46])[S:37]2)[c:7]([NH:10][CH2:11][CH3:12])[cH:8][cH:9]1)=[O:16]Participants
3
Sources & evidence
- ORD record
- ord-bef68ba0fda44406be3f02a881fda796
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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