Hydrochloric Acid → 5-Chloro-3-(2-methoxyphenyl)-3-(4-pyridin-3-yl-piperazin-1-yl)-1,3-dihydro-indol-2-one

HRID 695571

Reaction equation

HRID 695571 reaction equation
[CH2:70]1[O:71][CH2:72][CH2:73][CH2:74]1.[CH:31]([N:32]([CH2:33][CH3:34])[CH:35]([CH3:36])[CH3:37])([CH3:38])[CH3:39].[Cl:11][c:12]1[cH:13][c:14]2[c:18]([cH:19][cH:20]1)[NH:17][C:16](=[O:21])[C:15]2([c:22]1[c:23]([O:28][CH3:29])[cH:24][cH:25][cH:26][cH:27]1)[OH:30].[Cl:53][CH:54]1[c:55]2[c:56]([cH:57][cH:58][cH:59][cH:60]2)[NH:61][C:62]1=[O:63].[Cl:64][CH2:65][Cl:66].[Cl:67][CH2:68][Cl:69].[ClH:52].[S:7]([Cl:8])([Cl:9])=[O:10].[cH:1]1[cH:2][cH:3][n:4][cH:5][cH:6]1.[n:40]1[cH:41][c:42]([N:46]2[CH2:47][CH2:48][NH:49][CH2:50][CH2:51]2)[cH:43][cH:44][cH:45]1>>[Cl:11][c:12]1[cH:13][c:14]2[c:18]([cH:19][cH:20]1)[NH:17][C:16](=[O:21])[C:15]2([c:22]1[c:23]([O:28][CH3:29])[cH:24][cH:25][cH:26][cH:27]1)[N:49]1[CH2:48][CH2:47][N:46]([c:42]2[cH:41][n:40][cH:45][cH:44][cH:43]2)[CH2:51][CH2:50]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 1049PyridineHCID 6344Dichloromethane2×HCID 8028TetrahydrofuranHCID 24386Thionyl ChlorideHCID 81531DiisopropylethylamineHCID 4372341-(Pyridin-3-yl)piperazineHCID 124185093-Chloro-1,3-dihydro-2H-indol-2-oneHCID 219059555-Chloro-3-hydroxy-3-(2-methoxyphenyl)indolin-2-one

Product 1

HCID 689063595-Chloro-3-(2-methoxyphenyl)-3-(4-pyridin-3-yl-piperazin-1-yl)-1,3-dihydro-indol-2-one

Sources & evidence

ORD record
ord-eba348b61ca4425ea213b123aa3921e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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