1-(4-Bromophenylsulfonyl)-4-methylpiperazine → HCID 59244766, compound

HRID 2342964Notes

Reaction equation

HRID 2342964 reaction equation
[Br:41][c:42]1[cH:43][cH:44][c:45]([S:46]([N:47]2[CH2:48][CH2:49][N:50]([CH3:51])[CH2:52][CH2:53]2)(=[O:54])=[O:55])[cH:56][cH:57]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([CH2:9][c:10]2[cH:11][cH:12][c:13]([O:14][CH3:15])[cH:16][cH:17]2)[c:18]2[n:19][cH:20][c:21](-[c:22]3[c:23]4[c:27]([n:28][c:29]([N:30]5[CH2:31][CH2:32][O:33][CH2:34][CH2:35]5)[n:36]3)[NH:26][CH2:25][CH2:24]4)[cH:37][n:38]2)[cH:39][cH:40]1.[CH3:58][O:59][c:60]1[cH:61][cH:62][c:63]([CH2:64][N:65]([c:66]2[n:67][cH:68][c:69](-[c:72]3[c:73]4[c:74]([n:75][c:76]([N:78]5[CH2:79][CH2:80][O:81][CH2:82][CH2:83]5)[n:77]3)[N:84]([c:87]3[cH:88][cH:89][c:90]([S:93](=[O:94])(=[O:95])[N:96]5[CH2:97][CH2:98][N:99]([CH3:102])[CH2:100][CH2:101]5)[cH:91][cH:92]3)[CH2:85][CH2:86]4)[cH:70][n:71]2)[CH2:103][c:104]2[cH:105][cH:106][c:107]([O:108][CH3:109])[cH:110][cH:111]2)[cH:112][cH:113]1>>[NH2:65][c:66]1[n:67][cH:68][c:69](-[c:72]2[c:73]3[c:74]([n:75][c:76]([N:78]4[CH2:79][CH2:80][O:81][CH2:82][CH2:83]4)[n:77]2)[N:84]([c:87]2[cH:88][cH:89][c:90]([S:93](=[O:94])(=[O:95])[N:96]4[CH2:97][CH2:98][N:99]([CH3:102])[CH2:100][CH2:101]4)[cH:91][cH:92]2)[CH2:85][CH2:86]3)[cH:70][n:71]1

Participants

4

Reactant 3

HCID 7107291-(4-Bromophenylsulfonyl)-4-methylpiperazineHCID 45258862Bis-(4-methoxybenzyl)-[5-(2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrimidin-2-yl]-amineHCID 67385944HCID 67385944, compound

Product 1

HCID 59244766HCID 59244766, compound

Sources & evidence

ORD record
ord-a1c1a7be877e48b983cc419687cf8fcf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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