Benzylamine → 5-(4-Benzylamino-3-nitro-phenyl)-6-ethyl-pyrimidine-2,4-diamine

HRID 2138161Notes

Reaction equation

HRID 2138161 reaction equation
[NH2:1][c:2]1[n:3][c:4]([CH2:19][CH3:20])[c:5](-[c:9]2[cH:10][c:11]([N+:16](=[O:17])[O-:18])[c:12]([Cl:15])[cH:13][cH:14]2)[c:6]([NH2:8])[n:7]1.[NH2:21][CH2:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[NH2:1][c:2]1[n:3][c:4]([CH2:19][CH3:20])[c:5](-[c:9]2[cH:10][c:11]([N+:16](=[O:17])[O-:18])[c:12]([NH:21][CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[cH:13][cH:14]2)[c:6]([NH2:8])[n:7]1

Participants

3

Reactant 2

HCID 7504BenzylamineHCID 3274042,4-Diamino-5-(3-amino-4-chloro-5-nitrophenyl)-6-ethylpyrimidine

Product 1

HCID 54813865-(4-Benzylamino-3-nitro-phenyl)-6-ethyl-pyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-33e0d84e10be41eeaca5fb26be1ce281
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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