Trifluoroacetic acid → HCID 66711078, compound

HRID 1208472Notes

Reaction equation

HRID 1208472 reaction equation
[CH3:8][S:9](=[O:10])[c:11]1[n:12][n:13]2[c:14]([cH:15][n:16]1)[cH:17][cH:18][c:19]2-[c:20]1[c:21]([O:26][CH3:27])[cH:22][cH:23][cH:24][cH:25]1.[NH2:28][c:29]1[cH:30][c:31]2[c:32]([cH:41][cH:42]1)[CH2:33][CH2:34][CH2:35][CH2:36][N:37]2[C:38]([CH3:39])=[O:40].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[c:11]1([NH:28][c:29]2[cH:30][c:31]3[c:32]([cH:41][cH:42]2)[CH2:33][CH2:34][CH2:35][CH2:36][N:37]3[C:38]([CH3:39])=[O:40])[n:12][n:13]2[c:14]([cH:15][n:16]1)[cH:17][cH:18][c:19]2-[c:20]1[c:21]([O:26][CH3:27])[cH:22][cH:23][cH:24][cH:25]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 574702581-(8-Amino-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)ethan-1-oneHCID 667107912-Methanesulfinyl-7-(2-methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazine

Product 1

HCID 66711078HCID 66711078, compound

Sources & evidence

ORD record
ord-e5715de360884e15877646cc35c4116e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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