6-(1,4,5,6-Tetrahydro-4-methyl-6-oxo-3-pyridazinyl)-2H-1,4-benzoxazin-3(4H)-one → 6-(3,4-Dihydro-1,4(2H)-benzoxazin-6-yl)-2,3,4,5-tetrahydro-5-methylpyridazin-3-one

HRID 89687Notes

Reaction equation

HRID 89687 reaction equation
[C:1](=[O:2])([CH3:3])[N:4]1[CH2:5][CH2:6][O:7][c:8]2[c:9]1[cH:10][c:11]([C:14]1=[N:19][NH:18][C:17](=[O:20])[CH2:16][CH:15]1[CH3:21])[cH:12][cH:13]2.[CH3:22][S:23]([N:24]1[c:25]2[cH:26][c:27]([C:28]3=[N:35][NH:34][C:32](=[O:33])[CH2:31][CH:29]3[CH3:30])[cH:36][cH:37][c:38]2[O:39][CH2:40][CH2:41]1)(=[O:42])=[O:43].[CH3:44][CH:45]1[CH2:46][NH:47][c:48]2[cH:49][c:50]([C:51]3=[N:57][NH:56][C:54](=[O:55])[CH2:53][CH2:52]3)[cH:58][cH:59][c:60]2[O:61]1.[CH3:62][CH:63]1[CH2:64][NH:65][c:66]2[cH:67][c:68]([C:69]3=[N:76][NH:75][C:73](=[O:74])[CH2:72][CH:70]3[CH3:71])[cH:77][cH:78][c:79]2[O:80]1.[O:81]=[C:82]1[NH:83][c:84]2[cH:85][c:86]([C:87]3=[N:93][NH:92][C:90](=[O:91])[CH2:89][CH2:88]3)[cH:94][cH:95][c:96]2[O:97][CH2:98]1.[O:99]=[C:100]1[NH:101][c:102]2[cH:103][c:104]([C:105]3=[N:112][NH:111][C:109](=[O:110])[CH2:108][CH:106]3[CH3:107])[cH:113][cH:114][c:115]2[O:116][CH2:117]1>>[NH:4]1[CH2:5][CH2:6][O:7][c:8]2[c:9]1[cH:10][c:11]([C:14]1=[N:19][NH:18][C:17](=[O:20])[CH2:16][CH:15]1[CH3:21])[cH:12][cH:13]2

Participants

7

Reactant 6

HCID 98166166-(1,4,5,6-Tetrahydro-4-methyl-6-oxo-3-pyridazinyl)-2H-1,4-benzoxazin-3(4H)-oneHCID 15599411HCID 15599411, compoundHCID 155994126-(3,4-dihydro-4-methanesulfonyl-1,4(2H)-benzoxazin-6-yl)-2,3,4,5-tetrahydro-5-methylpyridazin-3-oneHCID 155994136-(3,4-dihydro-2-methyl-1,4(2H)-benzoxazin-6-yl)-2,3,4,5-tetrahydropyridazin-3-oneHCID 15599414HCID 15599414, compoundHCID 15599415HCID 15599415, compound

Product 1

HCID 155994106-(3,4-Dihydro-1,4(2H)-benzoxazin-6-yl)-2,3,4,5-tetrahydro-5-methylpyridazin-3-one

Sources & evidence

ORD record
ord-aedb949826194cf4b6a8ed0e137c715b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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