Ethanol → HCID 22156956, compound

HRID 696268Notes

Reaction equation

HRID 696268 reaction equation
[C:1](=[O:2])([O:3][CH2:4][CH3:5])[C:6]1=[C:7]([CH2:27][SH:28])[NH:8][C:9]([CH3:26])=[C:10]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH:11]1[c:12]1[cH:13][c:14]([N+:18](=[O:19])[O-:20])[cH:15][cH:16][cH:17]1.[CH2:29]=[O:30].[CH2:31]1[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]1.[CH3:37][CH2:38][OH:39]>>[C:1](=[O:2])([O:3][CH2:4][CH3:5])[C:6]1=[C:7]([CH2:27][S:28][CH2:29][N:34]2[CH2:33][CH2:32][CH2:31][CH2:36][CH2:35]2)[NH:8][C:9]([CH3:26])=[C:10]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH:11]1[c:12]1[cH:13][c:14]([N+:18](=[O:19])[O-:20])[cH:15][cH:16][cH:17]1

Participants

5

Reactant 4

HCID 702EthanolHCID 712FormaldehydeHCID 8082PiperidineHCID 116758332-Mercaptomethyl-3,5-dicarboetoxy-4-(m-nitrophenyl)-6-methyl-1,4-dihydropyridine

Product 1

HCID 22156956HCID 22156956, compound

Sources & evidence

ORD record
ord-f3f5ca73d09b4107951e324bb10b289f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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