Hydrochloric Acid → N-{4-[(2-amino-6-methyl-4-pyrimidinyl)amino]phenyl}-5-nitro-2-pyridinecarboxamide

HRID 290946Notes

Reaction equation

HRID 290946 reaction equation
[CH2:30]([N:31]([CH2:32][CH3:33])[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)[CH3:40].[ClH:13].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:10](=[O:11])[OH:12])[n:8][cH:9]1.[NH2:14][c:15]1[cH:16][cH:17][c:18]([NH:21][c:22]2[n:23][c:24]([NH2:29])[n:25][c:26]([CH3:28])[cH:27]2)[cH:19][cH:20]1.[P:41]([Cl:42])([Cl:43])([Cl:44])=[O:45]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([C:10](=[O:12])[NH:14][c:15]2[cH:16][cH:17][c:18]([NH:21][c:22]3[n:23][c:24]([NH2:29])[n:25][c:26]([CH3:28])[cH:27]3)[cH:19][cH:20]2)[n:8][cH:9]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 7061N,N-DiethylanilineHCID 24813Phosphorus oxychlorideHCID 5204885-Nitropicolinic acidHCID 59457937HCID 59457937, compound

Product 1

HCID 59458006N-{4-[(2-amino-6-methyl-4-pyrimidinyl)amino]phenyl}-5-nitro-2-pyridinecarboxamide

Sources & evidence

ORD record
ord-943e9c1dbfb04589adfc4bc37af5695d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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