Hydrochloric Acid → HCID 66616576, compound

HRID 1561044Notes

Reaction equation

HRID 1561044 reaction equation
[CH3:30][O:31][c:32]1[cH:33][c:34]([C:35]2=[N:49][N:42]([CH:43]3[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]3)[C:40](=[O:41])[C:36]2([CH2:37][CH3:38])[CH3:39])[cH:50][cH:51][c:52]1[O:53][CH3:54].[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[CH2:6][CH2:7][CH:8]([N:11]2[N:12]=[C:13]([c:19]3[cH:20][c:21]([O:27][CH3:28])[c:22]([O:25][CH3:26])[cH:23][cH:24]3)[C:14]([CH3:17])([CH3:18])[C:15]2=[O:16])[CH2:9][CH2:10]1.[Cl:55][CH2:56][C:57]([O:58][C:59](=[O:60])[CH2:61][Cl:62])=[O:63].[ClH:29]>>[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[CH2:6][CH2:7][CH:8]([N:11]2[N:12]=[C:13]([c:19]3[cH:20][c:21]([O:27][CH3:28])[c:22]([O:25][CH3:26])[cH:23][cH:24]3)[C:14]([CH3:17])([CH2:18][CH3:30])[C:15]2=[O:16])[CH2:9][CH2:10]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 10946Chloroacetic anhydrideHCID 666166092-[1-(chloroacetyl)piperidin-4-yl]-5-(3,4-dimethoxyphenyl)-4,4-dimethyl-2,4-dihydro-3H-pyrazol-3-oneHCID 66616631HCID 66616631, compound

Product 1

HCID 66616576HCID 66616576, compound

Sources & evidence

ORD record
ord-2c274498069147a88e8e1aa49be2192f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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