2-(2-[Aminomethyl]phenylthio)acetic acid → HCID 178431848, compound
Reaction equation
[NH2:17][CH2:18][c:19]1[c:20]([S:25][CH2:26][C:27](=[O:28])[OH:29])[cH:21][cH:22][cH:23][cH:24]1.[NH2:1][CH:2]1[CH:3]2[N:4]([CH:5]([c:10]3[n:11][n:12][n:13][nH:14]3)[C:6]([CH3:8])([CH3:9])[S:7]2)[C:15]1=[O:16]>>[NH:1]([CH:2]1[CH:3]2[N:4]([CH:5]([c:10]3[nH:11][n:12][n:13][n:14]3)[C:6]([CH3:8])([CH3:9])[S:7]2)[C:15]1=[O:16])[C:27]([CH2:26][S:25][c:20]1[c:19]([CH2:18][NH2:17])[cH:24][cH:23][cH:22][cH:21]1)=[O:28]Participants
3
Sources & evidence
- ORD record
- ord-a35582fe9e434dc7a6ea0890187efc8f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…