Ethanol → HCID 51346414, compound

HRID 2337181Notes

Reaction equation

HRID 2337181 reaction equation
[CH2:35]1[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]1.[CH3:17][c:18]1[c:19]([CH:33]=[O:34])[nH:20][c:21]([CH3:32])[c:22]1[C:23](=[O:24])[N:25]1[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]1.[CH3:41][CH2:42][OH:43].[c:1]1(-[c:7]2[c:8]3[c:12]([cH:13][cH:14][cH:15]2)[NH:11][C:10](=[O:16])[CH2:9]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[c:8]3[c:12]([cH:13][cH:14][cH:15]2)[NH:11][C:10](=[O:16])[C:9]3=[CH:33][c:19]2[c:18]([CH3:17])[c:22]([C:23](=[O:24])[N:25]3[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]3)[c:21]([CH3:32])[nH:20]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8082PiperidineHCID 121115823,5-dimethyl-4-(4-methylpiperazine-1-carbonyl)-1H-pyrrole-2-carbaldehydeHCID 130486014-Phenylindolin-2-one

Product 1

HCID 51346414HCID 51346414, compound

Sources & evidence

ORD record
ord-c1103db14c504b25acd3aa4e1b9d20ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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