2-Piperazin-1-yl-thiazole-5-carbonitrile → 2-[4-(2-Isobutoxy-5-methanesulfonyl-benzoyl)-piperazin-1-yl]-thiazole-5-carbonitrile

HRID 674078Notes

Reaction equation

HRID 674078 reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][c:6]1[c:7]([C:8](=[O:9])[OH:10])[cH:11][c:12]([S:15](=[O:16])(=[O:17])[CH3:18])[cH:13][cH:14]1.[N:19]1([c:25]2[s:26][c:27]([C:30]#[N:31])[cH:28][n:29]2)[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]1>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][c:6]1[c:7]([C:8](=[O:10])[N:22]2[CH2:21][CH2:20][N:19]([c:25]3[s:26][c:27]([C:30]#[N:31])[cH:28][n:29]3)[CH2:24][CH2:23]2)[cH:11][c:12]([S:15](=[O:16])(=[O:17])[CH3:18])[cH:13][cH:14]1

Participants

3

Reactant 2

HCID 211002572-Piperazin-1-yl-thiazole-5-carbonitrileHCID 235031102-Isobutoxy-5-methanesulfonyl-benzoic acid

Product 1

HCID 116623382-[4-(2-Isobutoxy-5-methanesulfonyl-benzoyl)-piperazin-1-yl]-thiazole-5-carbonitrile

Sources & evidence

ORD record
ord-f13d218a826d4e2793377020db0337b9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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