Diethyl Ether → 5-O-ethyl 3-O-methyl 4-(2-chlorophenyl)-2-methyl-6-[4-(methylcarbamoylamino)butoxymethyl]-1,4-dihydropyridine-3,5-dicarboxylate

HRID 90333Notes

Reaction equation

HRID 90333 reaction equation
[CH2:40]([Cl:41])[Cl:42].[CH3:1][N:2]=[C:3]=[O:4].[CH3:35][CH2:36][O:37][CH2:38][CH3:39].[NH2:5][CH2:6][CH2:7][CH2:8][CH2:9][O:10][CH2:11][C:12]1=[C:17]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[CH:16]([c:23]2[c:24]([Cl:29])[cH:25][cH:26][cH:27][cH:28]2)[C:15]([C:30](=[O:31])[O:32][CH3:33])=[C:14]([CH3:34])[NH:13]1>>[CH3:1][NH:2][C:3](=[O:4])[NH:5][CH2:6][CH2:7][CH2:8][CH2:9][O:10][CH2:11][C:12]1=[C:17]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[CH:16]([c:23]2[c:24]([Cl:29])[cH:25][cH:26][cH:27][cH:28]2)[C:15]([C:30](=[O:31])[O:32][CH3:33])=[C:14]([CH3:34])[NH:13]1

Participants

5

Reactant 4

HCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 12228Methyl IsocyanateHCID 70381380HCID 70381380, compound

Product 1

HCID 233208185-O-ethyl 3-O-methyl 4-(2-chlorophenyl)-2-methyl-6-[4-(methylcarbamoylamino)butoxymethyl]-1,4-dihydropyridine-3,5-dicarboxylate

Sources & evidence

ORD record
ord-140d3e9963af422ba52c998abec0d025
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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