Acetone → HCID 178498796, compound

HRID 1114480Notes

Reaction equation

HRID 1114480 reaction equation
[CH3:10][C:11](=[O:12])[CH3:13].[CH3:14][c:15]1[n:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[c:23]([CH2:25][c:26]2[cH:27][cH:28][c:29]([C:30](=[O:31])[NH:32][CH:33]3[CH:34]([C:38](=[O:39])[O:40][CH3:41])[CH2:35][NH:36][CH2:37]3)[cH:42][cH:43]2)[cH:24]1.[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[CH:1]([CH3:2])([CH3:3])[N:4]([CH:5]([CH3:6])[CH3:7])[CH2:8][CH3:9].[Cl:44][CH2:45][Cl:46]>>[CH:1]([CH3:2])([CH3:3])[N:36]1[CH2:35][CH:34]([C:38](=[O:39])[O:40][CH3:41])[CH:33]([NH:32][C:30]([c:29]2[cH:28][cH:27][c:26]([CH2:25][c:23]3[c:22]4[c:17]([n:16][c:15]([CH3:14])[cH:24]3)[cH:18][cH:19][cH:20][cH:21]4)[cH:43][cH:42]2)=[O:31])[CH2:37]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 178498765HCID 178498765, compound

Product 1

HCID 178498796HCID 178498796, compound

Sources & evidence

ORD record
ord-685b9cb4677c45bd9bfdc30b8ce0320e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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