Dichloromethane → HCID 178432111, compound
Reaction equation
[CH2:45]([Cl:46])[Cl:47].[CH3:1][c:2]1[n:3][c:4]2[c:5]([n:6]1[CH:7]1[CH2:8][CH:9]3[CH2:10][CH2:11][CH:12]([CH2:13]1)[N:14]3[CH2:15][CH2:16][C:17]1([c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]1)[cH:29][cH:30][cH:31][cH:32]2.[n:33]1([C:38](=[S:39])[n:40]2[cH:41][cH:42][n:43][cH:44]2)[cH:34][n:35][cH:36][cH:37]1>>[CH3:1][c:2]1[n:3][c:4]2[c:5]([n:6]1[CH:7]1[CH2:8][CH:9]3[CH2:10][CH2:11][CH:12]([CH2:13]1)[N:14]3[CH2:15][CH2:16][C:17]1([c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:18][CH2:19][N:20]([C:38]([n:33]3[cH:34][n:35][cH:36][cH:37]3)=[S:39])[CH2:21][CH2:22]1)[cH:29][cH:30][cH:31][cH:32]2Participants
4
Sources & evidence
- ORD record
- ord-d61164fa4e1a45caa86b708dbf315ac3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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