Acetonitrile → HCID 25122618, compound

HRID 1133039Notes

Reaction equation

HRID 1133039 reaction equation
[CH3:41][C:42]#[N:43].[NH2:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7](-[c:11]2[cH:12][cH:13][c:14]3[n:15][cH:16][c:17]([N:21]4[CH2:22][CH2:23][N:24]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH2:25][CH2:26]4)[n:18][c:19]3[cH:20]2)[cH:8][n:9][cH:10]1.[OH:34][C:35]([C:36]([F:37])([F:38])[F:39])=[O:40]>>[NH2:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7](-[c:11]2[cH:12][cH:13][c:14]3[n:15][cH:16][c:17]([N:21]4[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]4)[n:18][c:19]3[cH:20]2)[cH:8][n:9][cH:10]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 57843350HCID 57843350, compound

Product 1

HCID 25122618HCID 25122618, compound

Sources & evidence

ORD record
ord-2fa77a82d5bc4612ade85363f1471d7a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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