Hydrochloric Acid → 1-(2-(3-aminopropyl)-5-(3-fluorophenyl)-2-phenyl-1,3,4-thiadiazol-3(2H)-yl)-2-methylpropan-1-one

HRID 188385Notes

Reaction equation

HRID 188385 reaction equation
[C:2]([O:3][C:4](=[O:5])[NH:8][CH2:9][CH2:10][CH2:11][C:12]1([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[S:13][C:14]([c:22]2[cH:23][c:24]([F:28])[cH:25][cH:26][cH:27]2)=[N:15][N:16]1[C:17]([CH:18]([CH3:19])[CH3:20])=[O:21])([CH3:6])([CH3:7])[CH3:35].[ClH:1]>>[NH2:8][CH2:9][CH2:10][CH2:11][C:12]1([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[S:13][C:14]([c:22]2[cH:23][c:24]([F:28])[cH:25][cH:26][cH:27]2)=[N:15][N:16]1[C:17]([CH:18]([CH3:19])[CH3:20])=[O:21]

Participants

3

Reactant 2

HCID 313Hydrochloric AcidHCID 67215274{3-[5-(3-Fluorophenyl)-3-isobutyryl-2-phenyl-2,3-dihydro-[1,3,4]thiadiazol-2-yl]-propyl}-carbamic acid tert-butyl ester

Product 1

HCID 250991931-(2-(3-aminopropyl)-5-(3-fluorophenyl)-2-phenyl-1,3,4-thiadiazol-3(2H)-yl)-2-methylpropan-1-one

Sources & evidence

ORD record
ord-2fb55dab3ed848b79127f470f2961408
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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