Benzene → HCID 21846256, compound

HRID 1568901Notes

Reaction equation

HRID 1568901 reaction equation
[NH2:1][c:2]1[n:3][c:4]([CH:19]([CH3:20])[CH3:21])[cH:5][c:6](-[c:8]2[cH:9][cH:10][c:11]([F:18])[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]23)[n:7]1.[O:22]=[C:23]=[N:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[NH:1]([c:2]1[n:3][c:4]([CH:19]([CH3:20])[CH3:21])[cH:5][c:6](-[c:8]2[cH:9][cH:10][c:11]([F:18])[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]23)[n:7]1)[C:23](=[O:22])[NH:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1

Participants

4

Reactant 3

HCID 241BenzeneHCID 7672Phenyl isocyanateHCID 1969684-(4-Fluoro-1-naphthalenyl)-6-(1-methylethyl)-2-pyrimidinamine

Product 1

HCID 21846256HCID 21846256, compound

Sources & evidence

ORD record
ord-0337b44fb41f420c95f7013d5483aa45
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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