Ethanol → N-{3-[6-(3-Amino-4-methylamino-phenylamino)-4-methyl-5-oxo-4,5-dihydro-pyrazin-2-yl]-2-methyl-phenyl}-4-tert-butyl-benzamide

HRID 165659Notes

Reaction equation

HRID 165659 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[NH:11][c:12]2[c:13]([CH3:38])[c:14](-[c:18]3[n:19][c:20]([NH:26][c:27]4[cH:28][c:29]([N+:35]([O-:36])=[O:37])[c:30]([NH:33][CH3:34])[cH:31][cH:32]4)[c:21](=[O:25])[n:22]([CH3:24])[cH:23]3)[cH:15][cH:16][cH:17]2)[cH:39][cH:40]1.[CH3:41][CH2:42][OH:43].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[H:44][H:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[NH:11][c:12]2[c:13]([CH3:38])[c:14](-[c:18]3[n:19][c:20]([NH:26][c:27]4[cH:28][c:29]([NH2:35])[c:30]([NH:33][CH3:34])[cH:31][cH:32]4)[c:21](=[O:25])[n:22]([CH3:24])[cH:23]3)[cH:15][cH:16][cH:17]2)[cH:39][cH:40]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8857Ethyl AcetateHCID 587290344-tert-Butyl-N-{2-methyl-3-[4-methyl-6-(4-methylamino-3-nitro-phenylamino)-5-oxo-4,5-dihydro-pyrazin-2-yl]-phenyl}-benzamideHCID 178418361HCID 178418361, compound

Product 1

HCID 58729140N-{3-[6-(3-Amino-4-methylamino-phenylamino)-4-methyl-5-oxo-4,5-dihydro-pyrazin-2-yl]-2-methyl-phenyl}-4-tert-butyl-benzamide

Sources & evidence

ORD record
ord-65a27f515273440c825216b4b28b66c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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