Acetonitrile → HCID 25172497, compound

HRID 294149Notes

Reaction equation

HRID 294149 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][n:7]([CH2:25][CH:26]2[CH2:27][N:28]([S:30](=[O:31])(=[O:32])[CH:33]3[CH2:34][CH2:35]3)[CH2:29]2)[c:8](=[N:10][C:11]([c:12]2[c:13]([O:22][CH3:23])[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)=[S:24])[s:9]1.[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:46][C:47]#[N:48].[NH2:43][C:44]#[N:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][n:7]([CH2:25][CH:26]2[CH2:27][N:28]([S:30](=[O:31])(=[O:32])[CH:33]3[CH2:34][CH2:35]3)[CH2:29]2)[c:8](=[N:10][C:11]([c:12]2[c:13]([O:22][CH3:23])[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]2)=[N:45][C:44]#[N:43])[s:9]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 9864CyanamideHCID 87179764HCID 87179764, compound

Product 1

HCID 25172497HCID 25172497, compound

Sources & evidence

ORD record
ord-0082dfd20ad54e8a864afb134c44a1c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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