1-Ethylpiperazine → HCID 59244476, compound

HRID 1541027Notes

Reaction equation

[CH2:48]([N:49]1[CH2:50][CH2:51][NH:52][CH2:53][CH2:54]1)[CH3:55].[CH2:56]([CH3:57])[N:58]1[CH2:59][CH2:60][N:61]([c:64]2[cH:65][cH:66][c:67]([N:70]3[CH2:71][CH2:72][c:73]4[c:74]3[n:75][c:76]([N:104]3[CH2:105][CH2:106][O:107][CH2:108][CH2:109]3)[n:77][c:78]4-[c:79]3[cH:80][n:81][c:82]([N:85]([CH2:86][c:87]4[cH:88][cH:89][c:90]([O:91][CH3:92])[cH:93][cH:94]4)[CH2:95][c:96]4[cH:97][cH:98][c:99]([O:100][CH3:101])[cH:102][cH:103]4)[n:83][cH:84]3)[cH:68][n:69]2)[CH2:62][CH2:63]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([N:6]2[c:7]3[n:8][c:9]([N:10]4[CH2:11][CH2:12][O:13][CH2:14][CH2:15]4)[n:16][c:17](-[c:18]4[cH:19][n:20][c:21]([N:22]([CH2:23][c:24]5[cH:25][cH:26][c:27]([O:28][CH3:29])[cH:30][cH:31]5)[CH2:32][c:33]5[cH:34][cH:35][c:36]([O:37][CH3:38])[cH:39][cH:40]5)[n:41][cH:42]4)[c:43]3[CH2:44][CH2:45]2)[cH:46][cH:47]1>>[CH2:56]([CH3:57])[N:58]1[CH2:59][CH2:60][N:61]([c:64]2[cH:65][cH:66][c:67]([N:70]3[CH2:71][CH2:72][c:73]4[c:74]3[n:75][c:76]([N:104]3[CH2:105][CH2:106][O:107][CH2:108][CH2:109]3)[n:77][c:78]4-[c:79]3[cH:80][n:81][c:82]([NH2:85])[n:83][cH:84]3)[cH:68][n:69]2)[CH2:62][CH2:63]1

Participants

Reactant 3

HCID 791961-Ethylpiperazine

HCID 59244926HCID 59244926, compound

HCID 67385767HCID 67385767, compound

Product 1

HCID 59244476HCID 59244476, compound

Sources & evidence

ORD record: ord-5bd6dfdae7814b66a4171139be181e82
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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