Toluene → N-(2-Nitrophenyl)-N'-(3-bromo-4-ethoxyphenyl)-urea

HRID 1142776Notes

Reaction equation

HRID 1142776 reaction equation
[Br:13][c:14]1[cH:15][c:16]([NH2:17])[cH:18][cH:19][c:20]1[O:21][CH2:22][CH3:23].[CH3:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29].[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([N:10]=[C:11]=[O:12])[cH:6][cH:7][cH:8][cH:9]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([NH:10][C:11](=[O:12])[NH:17][c:16]2[cH:15][c:14]([Br:13])[c:20]([O:21][CH2:22][CH3:23])[cH:19][cH:18]2)[cH:6][cH:7][cH:8][cH:9]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 8058HexaneHCID 768342-Nitrophenyl isocyanateHCID 152708853-Bromo-4-ethoxyaniline

Product 1

HCID 21473031N-(2-Nitrophenyl)-N'-(3-bromo-4-ethoxyphenyl)-urea

Sources & evidence

ORD record
ord-14604dba54594adeac4e6195b592e165
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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