Methanol → (+/-)-1-(4-Amino-quinazolin-7-ylmethyl)-4-(6-chloro-benzo[b]thiophene-2-sulfonyl)-6-oxo-piperazine-2-carboxylic acid
Reaction equation
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:1][O:2][C:3](=[O:4])[CH:5]1[N:6]([CH2:25][c:26]2[cH:27][cH:28][c:29]3[c:30]([NH2:36])[n:31][cH:32][n:33][c:34]3[cH:35]2)[C:7](=[O:24])[CH2:8][N:9]([S:11](=[O:12])(=[O:13])[c:14]2[cH:15][c:16]3[c:17]([s:18]2)[cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[CH2:10]1.[CH3:42][OH:43].[OH2:44]>>[O:2]=[C:3]([OH:4])[CH:5]1[N:6]([CH2:25][c:26]2[cH:27][cH:28][c:29]3[c:30]([NH2:36])[n:31][cH:32][n:33][c:34]3[cH:35]2)[C:7](=[O:24])[CH2:8][N:9]([S:11](=[O:12])(=[O:13])[c:14]2[cH:15][c:16]3[c:17]([s:18]2)[cH:19][c:20]([Cl:23])[cH:21][cH:22]3)[CH2:10]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-e5b627def8bd4f1bb6234ff3635d98d3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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