Dimethyl Sulfoxide → HCID 178486509, compound
Reaction equation
[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[CH3:48][S:49]([CH3:50])=[O:51].[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[Cl:12][c:13]1[c:14]([CH:19]2[NH:20][CH2:21][CH2:22][c:23]3[cH:24][c:25]([O:31][CH3:32])[c:26]([O:29][CH3:30])[cH:27][c:28]32)[cH:15][cH:16][cH:17][cH:18]1.[Cl:1][c:2]1[c:3]2[n:4][cH:5][nH:6][c:7]2[n:8][c:9]([NH2:11])[n:10]1.[OH2:52]>>[c:2]1([N:20]2[CH:19]([c:14]3[c:13]([Cl:12])[cH:18][cH:17][cH:16][cH:15]3)[c:28]3[c:23]([cH:24][c:25]([O:31][CH3:32])[c:26]([O:29][CH3:30])[cH:27]3)[CH2:22][CH2:21]2)[c:3]2[n:4][cH:5][nH:6][c:7]2[n:8][c:9]([NH2:11])[n:10]1Participants
7
Sources & evidence
- ORD record
- ord-4ffcf291ac694c12b896431804eb9f6d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…