Acetonitrile → HCID 54029568, compound

HRID 290129Notes

Reaction equation

HRID 290129 reaction equation
[C:1]([CH2:2][CH3:3])(=[O:4])[c:5]1[cH:6][n:7][c:8]2[c:9]([O:16][CH2:17][CH2:18][S:19][CH2:20][CH2:21][CH3:22])[cH:10][cH:11][cH:12][c:13]2[c:14]1[Cl:15].[CH3:31][C:32]#[N:33].[NH2:23][c:24]1[c:25]([CH3:30])[cH:26][cH:27][cH:28][cH:29]1>>[C:1]([CH2:2][CH3:3])(=[O:4])[c:5]1[cH:6][n:7][c:8]2[c:9]([O:16][CH2:17][CH2:18][S:19][CH2:20][CH2:21][CH3:22])[cH:10][cH:11][cH:12][c:13]2[c:14]1[NH:23][c:24]1[c:25]([CH3:30])[cH:26][cH:27][cH:28][cH:29]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 7242O-ToluidineHCID 54378137HCID 54378137, compound

Product 1

HCID 54029568HCID 54029568, compound

Sources & evidence

ORD record
ord-789218475c56477ba37752ecf7aa52b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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