Hydrochloric Acid → HCID 67345087, compound

HRID 2124614Notes

Reaction equation

HRID 2124614 reaction equation
[CH3:42][CH:43]([OH:44])[CH3:45].[CH:33]([N:34]([CH:35]([CH3:36])[CH3:37])[CH2:38][CH3:39])([CH3:40])[CH3:41].[ClH:23].[F:24][C:25]1([F:32])[CH2:26][CH2:27][CH:28]([NH2:31])[CH2:29][CH2:30]1.[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[c:18]3[Cl:19])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[c:18]3[NH:31][CH:28]2[CH2:27][CH2:26][C:25]([F:24])([F:32])[CH2:30][CH2:29]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 3776IsopropanolHCID 81531DiisopropylethylamineHCID 3847030(4,4-Difluorocyclohexyl)amineHCID 583947741-(benzenesulfonyl)-4-chloro-5-nitro-1H-pyrrolo(2,3-b)pyridine

Product 1

HCID 67345087HCID 67345087, compound

Sources & evidence

ORD record
ord-6c2afcbe24484906b2b3953955982122
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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