3-Cyanobenzoic acid → HCID 68442448, compound

HRID 695184Notes

Reaction equation

HRID 695184 reaction equation
[C:24](#[N:25])[c:26]1[cH:27][c:28]([C:29](=[O:30])[OH:31])[cH:32][cH:33][cH:34]1.[NH2:1][CH2:2][CH:3]1[CH:4]2[CH2:5][CH:6]2[CH2:7][N:8]1[C:9](=[O:10])[c:11]1[n:12][c:13]([CH3:23])[s:14][c:15]1-[c:16]1[cH:17][c:18]([CH3:22])[cH:19][cH:20][cH:21]1>>[NH:1]([CH2:2][CH:3]1[CH:4]2[CH2:5][CH:6]2[CH2:7][N:8]1[C:9](=[O:10])[c:11]1[n:12][c:13]([CH3:23])[s:14][c:15]1-[c:16]1[cH:17][c:18]([CH3:22])[cH:19][cH:20][cH:21]1)[C:29]([c:28]1[cH:27][c:26]([C:24]#[N:25])[cH:34][cH:33][cH:32]1)=[O:30]

Participants

3

Reactant 2

HCID 158753-Cyanobenzoic acidHCID 68444173[2-(Aminomethyl)-3-azabicyclo[3.1.0]hexan-3-yl]-[2-methyl-5-(3-methylphenyl)-1,3-thiazol-4-yl]methanone

Product 1

HCID 68442448HCID 68442448, compound

Sources & evidence

ORD record
ord-875357a7107549838ab83769c89c4af2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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