Methanesulfonyl chloride → [4-(2,5-dimethylpyrrol-1-yl)-1-propan-2-ylcyclopent-2-en-1-yl]-[3-(trifluoromethyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]methanone

HRID 2129809Notes

Reaction equation

HRID 2129809 reaction equation
[CH3:15][c:16]1[n:17]([CH:22]2[CH:23]=[CH:24][C:25]([C:27](=[O:28])[OH:29])([CH:30]([CH3:31])[CH3:32])[CH2:26]2)[c:18]([CH3:21])[cH:19][cH:20]1.[CH3:33][S:34](=[O:35])(=[O:36])[Cl:37].[F:1][C:2]([c:3]1[cH:4][n:5][c:6]2[c:11]([cH:12]1)[CH2:10][NH:9][CH2:8][CH2:7]2)([F:13])[F:14]>>[F:1][C:2]([c:3]1[cH:4][n:5][c:6]2[c:11]([cH:12]1)[CH2:10][N:9]([C:27]([C:25]1([CH:30]([CH3:31])[CH3:32])[CH:24]=[CH:23][CH:22]([n:17]3[c:16]([CH3:15])[cH:20][cH:19][c:18]3[CH3:21])[CH2:26]1)=[O:28])[CH2:8][CH2:7]2)([F:13])[F:14]

Participants

4

Reactant 3

HCID 31297Methanesulfonyl chlorideHCID 114810975,6,7,8-Tetrahydro-3-(trifluoromethyl)-1,6-naphthyridineHCID 72833403(1S,4S)-4-(2,5-diMethyl-1H-pyrrol-1-yl)-1-(propan-2-yl)cyclopent-2-ene-1-carboxylic acid

Product 1

HCID 72361980[4-(2,5-dimethylpyrrol-1-yl)-1-propan-2-ylcyclopent-2-en-1-yl]-[3-(trifluoromethyl)-7,8-dihydro-5H-1,6-naphthyridin-6-yl]methanone

Sources & evidence

ORD record
ord-83738823e53349f8a6bc6a208511a26d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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