Hydrochloric Acid → 2-[4-[2-[[2-(4-Chlorophenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3,5-dicyano-6-pyrrolidin-1-yl-4-pyridinyl]phenoxy]ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH3:10])[C:11](=[O:12])[OH:13].[CH3:15][N:16]([CH3:17])[CH2:18][CH2:19][CH2:20][N:21]=[C:22]=[N:23][CH2:24][CH3:25].[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[Cl:46][c:47]1[cH:48][cH:49][c:50](-[c:53]2[s:54][cH:55][c:56]([CH2:58][S:59][c:60]3[n:61][c:62]([N:80]4[CH2:81][CH2:82][CH2:83][CH2:84]4)[c:63]([C:78]#[N:79])[c:64](-[c:68]4[cH:69][cH:70][c:71]([O:74][CH2:75][CH2:76][OH:77])[cH:72][cH:73]4)[c:65]3[C:66]#[N:67])[n:57]2)[cH:51][cH:52]1.[ClH:14].[O:85]=[CH:86][N:87]([CH3:88])[CH3:89].[OH2:26].[OH:27][n:28]1[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2[n:35][n:36]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH3:10])[C:11](=[O:12])[O:13][CH2:76][CH2:75][O:74][c:71]1[cH:70][cH:69][c:68](-[c:64]2[c:63]([C:78]#[N:79])[c:62]([N:80]3[CH2:81][CH2:82][CH2:83][CH2:84]3)[n:61][c:60]([S:59][CH2:58][c:56]3[cH:55][s:54][c:53](-[c:50]4[cH:49][cH:48][c:47]([Cl:46])[cH:52][cH:51]4)[n:57]3)[c:65]2[C:66]#[N:67])[cH:73][cH:72]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-d41f8bd3e55f4f4db2909641af18f678
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…