Acetonitrile → HCID 18509158, compound

HRID 1137846Notes

Reaction equation

HRID 1137846 reaction equation
[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][C:40]#[N:41].[NH2:1][c:2]1[c:3]2[c:4](=[O:21])[c:5]([C:18](=[O:19])[OH:20])[cH:6][n:7]([CH:15]3[CH2:16][CH2:17]3)[c:8]2[c:9]([F:14])[c:10]([F:13])[c:11]1[F:12].[NH2:22][C:23]12[CH:24]3[CH2:25][NH:26][CH2:27][CH:28]3[CH2:29][CH:30]1[CH2:31]2>>[NH2:1][c:2]1[c:3]2[c:4](=[O:21])[c:5]([C:18](=[O:19])[OH:20])[cH:6][n:7]([CH:15]3[CH2:16][CH2:17]3)[c:8]2[c:9]([F:14])[c:10]([N:26]2[CH2:25][CH:24]3[C:23]4([NH2:22])[CH:30]([CH2:29][CH:28]3[CH2:27]2)[CH2:31]4)[c:11]1[F:12]

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 139109475-Amino-1-cyclopropyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acidHCID 55284375HCID 55284375, compound

Product 1

HCID 18509158HCID 18509158, compound

Sources & evidence

ORD record
ord-8d2c4959d4454e1388920d3652c80a70
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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