Acetonitrile → HCID 11501310, compound

HRID 1569352Notes

Reaction equation

HRID 1569352 reaction equation
[CH3:27][C:28]#[N:29].[Cl:1][C:2]1=[C:6]([c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[S:5](=[O:13])(=[O:14])[N:4]([CH:15]([CH3:16])[CH3:17])[C:3]1=[O:18].[NH2:19][CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[C:2]1([NH:19][CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)=[C:6]([c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[S:5](=[O:13])(=[O:14])[N:4]([CH:15]([CH3:16])[CH3:17])[C:3]1=[O:18]

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 7504BenzylamineHCID 672431604-Chloro-2-isopropyl-5-phenylisothiazol-3(2H)-one 1,1-dioxide

Product 1

HCID 11501310HCID 11501310, compound

Sources & evidence

ORD record
ord-3bcd441e0bbd46f7b6134d77dd2d933e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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