Dimethylformamide → (2-Benzhydryl-5-oxa-2,8-diazaspiro[3.5]nonan-8-yl)(5-methylthiophen-2-yl)methanone

HRID 177201Notes

Reaction equation

HRID 177201 reaction equation
[CH3:25][c:26]1[cH:27][cH:28][c:29]([C:31](=[O:32])[OH:33])[s:30]1.[CH3:56][CH2:57][N:58]([CH2:59][CH3:60])[CH2:61][CH3:62].[CH:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)([c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)[N:47]1[CH2:48][C:49]2([CH2:50]1)[O:51][CH2:52][CH2:53][NH:54][CH2:55]2.[O:63]=[CH:64][N:65]([CH3:66])[CH3:67].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[CH3:25][c:26]1[cH:27][cH:28][c:29]([C:31](=[O:33])[N:54]2[CH2:53][CH2:52][O:51][C:49]3([CH2:48][N:47]([CH:34]([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)[CH2:50]3)[CH2:55]2)[s:30]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 747135-Methylthiophene-2-carboxylic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 579892372-(Diphenylmethyl)-5-oxa-2,8-diazaspiro[3.5]nonane

Product 1

HCID 57989184(2-Benzhydryl-5-oxa-2,8-diazaspiro[3.5]nonan-8-yl)(5-methylthiophen-2-yl)methanone

Sources & evidence

ORD record
ord-deb022e7aaaf44caac9ecef5ba1aaada
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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