Formic Acid → 1-(2-{4-[7-(5-(Aminomethyl)-2-fluoropyridin-4-yl)benzo[b]thiophen-2-yl]-5-fluoropyrimidin-2-ylamino}ethyl)imidazolidin-2-one

HRID 690911Notes

Reaction equation

HRID 690911 reaction equation
[CH3:48][CH2:49][OH:50].[CH:37]([OH:38])=[O:39].[N:1](=[N+:2]=[N-:3])[CH2:4][c:5]1[c:6](-[c:12]2[cH:13][cH:14][cH:15][c:16]3[c:17]2[s:18][c:19](-[c:21]2[n:22][c:23]([NH:28][CH2:29][CH2:30][N:31]4[C:32](=[O:36])[NH:33][CH2:34][CH2:35]4)[n:24][cH:25][c:26]2[F:27])[cH:20]3)[cH:7][c:8]([F:11])[n:9][cH:10]1.[NH2:40][NH2:41].[Na+:42].[Na+:43].[O-:44][C:45](=[O:46])[O-:47]>>[NH2:1][CH2:4][c:5]1[c:6](-[c:12]2[cH:13][cH:14][cH:15][c:16]3[c:17]2[s:18][c:19](-[c:21]2[n:22][c:23]([NH:28][CH2:29][CH2:30][N:31]4[C:32](=[O:36])[NH:33][CH2:34][CH2:35]4)[n:24][cH:25][c:26]2[F:27])[cH:20]3)[cH:7][c:8]([F:11])[n:9][cH:10]1

Participants

7

Reactant 6

HCID 284Formic AcidHCID 702EthanolHCID 923Sodium ion2×HCID 9321HydrazineHCID 19660Carbonate IonHCID 86640496HCID 86640496, compound

Product 1

HCID 249368481-(2-{4-[7-(5-(Aminomethyl)-2-fluoropyridin-4-yl)benzo[b]thiophen-2-yl]-5-fluoropyrimidin-2-ylamino}ethyl)imidazolidin-2-one

Sources & evidence

ORD record
ord-b6722bb62e89413eb7ef353930403285
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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