Acetonitrile → HCID 178498726, compound

HRID 1219880Notes

Reaction equation

HRID 1219880 reaction equation
[C:1](#[N:2])[c:3]1[c:4]([Cl:22])[c:5]([F:21])[cH:6][c:7]2[c:8](=[O:20])[c:9]([C:16](=[O:17])[O:18][CH3:19])[cH:10][n:11]([CH:13]3[CH2:14][CH2:15]3)[c:12]12.[CH3:40][C:41]#[N:42].[CH:23]12[NH:24][CH2:25][CH2:26][CH2:27][CH:28]1[CH2:29][NH:30][CH2:31]2.[N:32]12[CH2:33][CH2:34][N:35]([CH2:36][CH2:37]1)[CH2:38][CH2:39]2>>[C:1](#[N:2])[c:3]1[c:4]([N:30]2[CH2:29][CH:28]3[CH:23]([NH:24][CH2:25][CH2:26][CH2:27]3)[CH2:31]2)[c:5]([F:21])[cH:6][c:7]2[c:8](=[O:20])[c:9]([C:16](=[O:17])[O:18][CH3:19])[cH:10][n:11]([CH:13]3[CH2:14][CH2:15]3)[c:12]12

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 9237DabcoHCID 5154241Octahydro-1H-pyrrolo[3,4-b]pyridineHCID 18351232Methyl 8-cyano-1-cyclopropyl-7-chloro-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylate

Product 1

HCID 178498726HCID 178498726, compound

Sources & evidence

ORD record
ord-ddc3391361594aff943203d2daaf207d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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