Acetonitrile → HCID 14210068, compound

HRID 682905Notes

Reaction equation

HRID 682905 reaction equation
[CH3:35][C:36]#[N:37].[Cl:1][C:2](=[O:3])[N:4]1[c:5]2[c:6]([cH:16][cH:17][cH:18][n:19]2)[NH:7][C:8](=[O:15])[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2.[N:20]1([CH2:26][CH:27]2[CH2:28][N:29]([CH2:32][CH2:33][NH2:34])[CH2:30][CH2:31]2)[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]1>>[C:2](=[O:3])([N:4]1[c:5]2[c:6]([cH:16][cH:17][cH:18][n:19]2)[NH:7][C:8](=[O:15])[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2)[NH:34][CH2:33][CH2:32][N:29]1[CH2:28][CH:27]([CH2:26][N:20]2[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]2)[CH2:31][CH2:30]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 1104396211-chlorocarbonyl-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-oneHCID 14210023HCID 14210023, compound

Product 1

HCID 14210068HCID 14210068, compound

Sources & evidence

ORD record
ord-52429f47eb774b7abb481f40e7def19f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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