Acetonitrile → HCID 15713456, compound

HRID 1230449Notes

Reaction equation

HRID 1230449 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][C:5]12[CH2:6][NH:7][CH2:8][CH:9]1[CH2:10]2.[CH3:11][CH2:12][N:13]([CH2:14][CH3:15])[CH2:16][CH3:17].[CH3:37][C:38]#[N:39].[Cl:18][c:19]1[c:20]([F:36])[cH:21][c:22]2[c:23](=[O:35])[c:24]([C:32](=[O:33])[OH:34])[cH:25][n:26]([CH:29]3[CH2:30][CH2:31]3)[c:27]2[n:28]1>>[C:1]([CH3:2])(=[O:3])[NH:4][C:5]12[CH2:6][N:7]([c:19]3[c:20]([F:36])[cH:21][c:22]4[c:23](=[O:35])[c:24]([C:32](=[O:33])[OH:34])[cH:25][n:26]([CH:29]5[CH2:30][CH2:31]5)[c:27]4[n:28]3)[CH2:8][CH:9]1[CH2:10]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 110551427-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acidHCID 157134351-Acetylamino-3-azabicyclo[3.1.0]hexane

Product 1

HCID 15713456HCID 15713456, compound

Sources & evidence

ORD record
ord-6179eab552964c4fa05dc9099d1e3fa4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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