Water → HCID 21551427, compound

HRID 1574793Notes

Reaction equation

HRID 1574793 reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10](-[n:15]2[n:16][c:17]([C:22](=[O:23])[OH:24])[n:18][c:19]2[CH2:20][Cl:21])[cH:11][cH:12][cH:13][cH:14]1.[C:32]([Cl:33])(=[O:34])[O:35][CH2:36][CH3:37].[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:38][N:39]1[CH2:40][CH2:41][NH:42][CH2:43][CH2:44]1.[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH2:45]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10](-[n:15]2[n:16][c:17]([C:22](=[O:24])[N:42]3[CH2:41][CH2:40][N:39]([CH3:38])[CH2:44][CH2:43]3)[n:18][c:19]2[CH2:20][Cl:21])[cH:11][cH:12][cH:13][cH:14]1

Participants

7

Reactant 6

HCID 962WaterHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 10928Ethyl chloroformateHCID 531671-MethylpiperazineHCID 13255885HCID 13255885, compound

Product 1

HCID 21551427HCID 21551427, compound

Sources & evidence

ORD record
ord-ef716295323a4b099ebc2ddd824cc4b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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