Water → HCID 57917029, compound
Reaction equation
[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH3:46])[c:6]2[c:7]([n:8][c:9](-[c:11]3[cH:12][cH:13][c:14]([NH:17][C:18]([CH2:19][O:20][CH:21]4[CH2:22][CH2:23][N:24]([C:27](=[O:28])[O:29][C:30]([CH2:31][O:32][CH2:33][c:34]5[cH:35][cH:36][c:37]([O:38][CH3:39])[cH:40][cH:41]5)([CH3:42])[CH3:43])[CH2:25][CH2:26]4)=[O:44])[cH:15][cH:16]3)[o:10]2)[cH:45]1.[Cl:48][C:49]1=[C:60]([Cl:61])[C:58](=[O:59])[C:55]([C:56]#[N:57])=[C:52]([C:53]#[N:54])[C:50]1=[O:51].[Cl:62][CH2:63][Cl:64].[OH2:47]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH3:46])[c:6]2[c:7]([n:8][c:9](-[c:11]3[cH:12][cH:13][c:14]([NH:17][C:18]([CH2:19][O:20][CH:21]4[CH2:22][CH2:23][N:24]([C:27](=[O:28])[O:29][C:30]([CH2:31][OH:32])([CH3:42])[CH3:43])[CH2:25][CH2:26]4)=[O:44])[cH:15][cH:16]3)[o:10]2)[cH:45]1Participants
5
Sources & evidence
- ORD record
- ord-eb87e39758624ef6a1e1fdad9d5a3a9c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…