Acetonitrile → HCID 21850844, compound

HRID 2318099Notes

Reaction equation

HRID 2318099 reaction equation
[C:1]([CH2:2][CH2:3][CH3:4])(=[O:5])[c:6]1[cH:7][n:8][c:9]2[c:10]([O:21][CH2:22][CH3:23])[n:11][cH:12][cH:13][c:14]2[c:15]1[O:16][S:17]([CH3:18])(=[O:19])=[O:20].[CH3:32][C:33]#[N:34].[NH2:24][c:25]1[c:26]([CH3:31])[cH:27][cH:28][cH:29][cH:30]1>>[C:1]([CH2:2][CH2:3][CH3:4])(=[O:5])[c:6]1[cH:7][n:8][c:9]2[c:10]([O:21][CH2:22][CH3:23])[n:11][cH:12][cH:13][c:14]2[c:15]1[NH:24][c:25]1[c:26]([CH3:31])[cH:27][cH:28][cH:29][cH:30]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 7242O-ToluidineHCID 21850863HCID 21850863, compound

Product 1

HCID 21850844HCID 21850844, compound

Sources & evidence

ORD record
ord-65876c2f8cda4d90b019120a06ac250c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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