Acetone → 3-(4-chlorophenyl)-N-((piperidin-1-yl)sulfonyl)-4-phenyl-4,5-dihydro-1H-pyrazole-1-carboximidothioic acid methyl ester

HRID 138410Notes

Reaction equation

HRID 138410 reaction equation
[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:38][I:39].[CH3:40][C:41](=[O:42])[CH3:43].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2=[N:9][N:10]([C:19]([NH:20][S:21](=[O:22])(=[O:23])[N:24]3[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]3)=[S:30])[CH2:11][CH:12]2[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2=[N:9][N:10]([C:19](=[N:20][S:21](=[O:22])(=[O:23])[N:24]3[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]3)[S:30][CH3:31])[CH2:11][CH:12]2[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 6328Methyl iodideHCID 8471TriethylamineHCID 22267339HCID 22267339, compound

Product 1

HCID 690559963-(4-chlorophenyl)-N-((piperidin-1-yl)sulfonyl)-4-phenyl-4,5-dihydro-1H-pyrazole-1-carboximidothioic acid methyl ester

Sources & evidence

ORD record
ord-6860708ab0c44d5da6ea9cd0d94635f7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…