Tetrahydrofuran → HCID 59208043, compound

HRID 303207Notes

Reaction equation

[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH:48]([N:49]([CH2:50][CH3:51])[CH:52]([CH3:53])[CH3:54])([CH3:55])[CH3:56].[F:1][c:2]1[c:3]([N:9]2[C:10](=[O:35])[NH:11][CH2:12][c:13]3[c:14]2[n:15][c:16]([S:32]([CH3:33])=[O:34])[n:17][c:18]3-[c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:24][CH:25]([CH3:26])[CH3:27])[cH:28][cH:29][c:30]2[CH3:31])[c:4]([F:8])[cH:5][cH:6][cH:7]1.[NH:36]1[CH2:37][CH2:38][CH:39]([N:42]2[CH2:43][CH2:44][O:45][CH2:46][CH2:47]2)[CH2:40][CH2:41]1>>[F:1][c:2]1[c:3]([N:9]2[C:10](=[O:35])[NH:11][CH2:12][c:13]3[c:14]2[n:15][c:16]([N:36]2[CH2:37][CH2:38][CH:39]([N:42]4[CH2:43][CH2:44][O:45][CH2:46][CH2:47]4)[CH2:40][CH2:41]2)[n:17][c:18]3-[c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:24][CH:25]([CH3:26])[CH3:27])[cH:28][cH:29][c:30]2[CH3:31])[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

Reactant 4

HCID 8028Tetrahydrofuran

HCID 81531Diisopropylethylamine

HCID 7957244-Morpholinopiperidine

HCID 119508203-[8-(2,6-difluorophenyl)-2-(methylsulfinyl)-7-oxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]-4-methyl-N-(1-methylethyl)benzamide

Product 1

HCID 59208043HCID 59208043, compound

Sources & evidence

ORD record: ord-43ff79ba37af4ae9bcec137ade22c060
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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