4-(Trifluoromethyl)benzenecarbothioyl chloride → N-[2-(4-Chloro-6-trifluoromethyl-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-trifluoromethylthiobenzamide

HRID 2326512Notes

Reaction equation

HRID 2326512 reaction equation
[F:21][C:22]([c:23]1[cH:24][cH:25][c:26]([C:27](=[S:28])[Cl:29])[cH:30][cH:31]1)([F:32])[F:33].[NH2:1][C:2]([C:3]#[N:4])([CH2:5][n:6]1[n:7][c:8]2[c:9]([n:10]1)[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][c:14]2[Cl:15])[CH3:20]>>[NH:1]([C:2]([C:3]#[N:4])([CH2:5][n:6]1[n:7][c:8]2[c:9]([n:10]1)[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][c:14]2[Cl:15])[CH3:20])[C:27]([c:26]1[cH:25][cH:24][c:23]([C:22]([F:21])([F:32])[F:33])[cH:31][cH:30]1)=[S:28]

Participants

3

Reactant 2

HCID 198624844-(Trifluoromethyl)benzenecarbothioyl chlorideHCID 666198862-amino-3-(4-chloro-6-trifluoromethyl-2H-benzotriazol-2-yl)-2-methylpropionitrile

Product 1

HCID 25122650N-[2-(4-Chloro-6-trifluoromethyl-2H-benzotriazol-2-yl)-1-cyano-1-methylethyl]-4-trifluoromethylthiobenzamide

Sources & evidence

ORD record
ord-870f3af4b06d43b9ac4e60d88f10d9e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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