Dichloromethane → methylcarbamic acid [5-(3,5-dichlorophenylthio)-1-isopropyl-4-[(4-pyridyl)methyl]-1H-pyrazol-3-yl]methyl ester

HRID 2343382Notes

Reaction equation

HRID 2343382 reaction equation
[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:34][N:35]=[C:36]=[O:37].[Cl:1][c:2]1[cH:3][c:4]([S:9][c:10]2[c:11]([CH2:20][c:21]3[cH:22][cH:23][n:24][cH:25][cH:26]3)[c:12]([CH2:18][OH:19])[n:13][n:14]2[CH:15]([CH3:16])[CH3:17])[cH:5][c:6]([Cl:8])[cH:7]1.[Cl:38][CH2:39][Cl:40]>>[Cl:1][c:2]1[cH:3][c:4]([S:9][c:10]2[c:11]([CH2:20][c:21]3[cH:22][cH:23][n:24][cH:25][cH:26]3)[c:12]([CH2:18][O:19][C:36]([NH:35][CH3:34])=[O:37])[n:13][n:14]2[CH:15]([CH3:16])[CH3:17])[cH:5][c:6]([Cl:8])[cH:7]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 12228Methyl IsocyanateHCID 514441[5-(3,5-Dichlorophenyl)sulfanyl-1-isopropyl-4-(4-pyridylmethyl)pyrazol-3-yl]methanol

Product 1

HCID 10139769methylcarbamic acid [5-(3,5-dichlorophenylthio)-1-isopropyl-4-[(4-pyridyl)methyl]-1H-pyrazol-3-yl]methyl ester

Sources & evidence

ORD record
ord-cb2c76a990fb43e5958bc2b98e0d21c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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