Acetonitrile → HCID 24641315, compound

HRID 2346221Notes

Reaction equation

HRID 2346221 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH2:13][CH:14]([C:17](=[O:18])[OH:19])[CH2:15][CH2:16]2)[cH:6][cH:7]1.[CH3:31][N:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[CH3:50][C:51]#[N:52].[Cl:20][c:21]1[n:22][c:23]([O:24][CH3:25])[n:26][c:27]([O:28][CH3:29])[n:30]1.[F:38][C:39]([O:40][c:41]1[cH:42][cH:43][c:44]([NH2:45])[cH:46][cH:47]1)([F:48])[F:49]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:12][CH2:13][CH:14]([C:17](=[O:18])[NH:45][c:44]3[cH:43][cH:42][c:41]([O:40][C:39]([F:38])([F:48])[F:49])[cH:47][cH:46]3)[CH2:15][CH2:16]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 79724-MethylmorpholineHCID 184502-Chloro-4,6-dimethoxy-1,3,5-triazineHCID 6008484-(Trifluoromethoxy)anilineHCID 7378401-(4-Methylbenzene-1-sulfonyl)piperidine-4-carboxylic acid

Product 1

HCID 24641315HCID 24641315, compound

Sources & evidence

ORD record
ord-8a4110b0e4a2411694fe6c1ebad48676
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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