Acetonitrile → HCID 22337637, compound

HRID 293076Notes

Reaction equation

HRID 293076 reaction equation
[C:18]([CH3:19])([CH3:20])([CH3:21])[c:22]1[cH:23][cH:24][c:25]([CH2:26][NH2:27])[cH:28][cH:29]1.[CH3:41][C:42]#[N:43].[Cl:1][C:2]([C:3](=[O:4])[NH:5][c:6]1[c:7]2[cH:8][n:9][nH:10][c:11]2[c:12]([CH3:15])[cH:13][cH:14]1)([Cl:16])[Cl:17].[N:30]12[CH2:31][CH2:32][CH2:33][N:34]=[C:35]1[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2>>[C:3](=[O:4])([NH:5][c:6]1[c:7]2[cH:8][n:9][nH:10][c:11]2[c:12]([CH3:15])[cH:13][cH:14]1)[NH:27][CH2:26][c:25]1[cH:24][cH:23][c:22]([C:18]([CH3:19])([CH3:20])[CH3:21])[cH:29][cH:28]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 27356554-tert-ButylbenzylamineHCID 22337658HCID 22337658, compound

Product 1

HCID 22337637HCID 22337637, compound

Sources & evidence

ORD record
ord-703cb1ca4ed64f3eacc87c074c18ff20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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