Dimethyl Sulfoxide → HCID 10337091, compound

HRID 2130667Notes

Reaction equation

HRID 2130667 reaction equation
[C:27](=[O:28])([O-:29])[O-:30].[CH3:33][S:34]([CH3:35])=[O:36].[CH:1]1([N:5]2[CH2:6][CH2:7][c:8]3[c:9]([cH:12][c:13]([OH:16])[cH:14][cH:15]3)[CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4]1.[F:17][c:18]1[cH:19][c:20]([C:21]#[N:22])[cH:23][cH:24][c:25]1[F:26].[K+:31].[K+:32]>>[CH:1]1([N:5]2[CH2:6][CH2:7][c:8]3[c:9]([cH:12][c:13]([O:16][c:25]4[c:18]([F:17])[cH:19][c:20]([C:21]#[N:22])[cH:23][cH:24]4)[cH:14][cH:15]3)[CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4]1

Participants

6

Reactant 5

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 5872033,4-DifluorobenzonitrileHCID 100820813-Cyclobutyl-2,3,4,5-tetrahydro-1H-benzo[D]azepin-7-OL

Product 1

HCID 10337091HCID 10337091, compound

Sources & evidence

ORD record
ord-b45b49b668174570a08f8dab3148478e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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