HCID 46314186, compound → HCID 178510015, compound

HRID 1227259Notes

Reaction equation

HRID 1227259 reaction equation
[C:1](#[N:2])[c:3]1[c:4](-[c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[cH:5][c:6]([NH2:7])[cH:8][cH:9]1.[N:17]([c:18]1[c:19]2[c:24]([c:25]([C:26]#[N:27])[cH:28][cH:29]1)[CH2:23][CH2:22][CH2:21][CH2:20]2)=[C:30]=[O:31].[OH:32][CH:33]1[CH2:34][CH2:35][N:36]2[C:37](=[O:54])[N:38]([c:42]3[c:43]4[c:48]([c:49]([C:50]#[N:51])[cH:52][cH:53]3)[CH2:47][CH2:46][CH2:45][CH2:44]4)[C:39](=[O:41])[CH:40]12>>[C:1](#[N:2])[c:3]1[c:4](-[c:10]2[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]2)[cH:5][c:6]([N:7]2[C:37](=[O:54])[N:36]3[CH2:35][CH2:34][CH:33]([OH:32])[CH:40]3[C:39]2=[O:41])[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 46314186HCID 46314186, compoundHCID 597543044-Isocyanato-5,6,7,8-tetrahydronaphthalene-1-carbonitrileHCID 708595274-(7-Hydroxy-1,3-dioxo-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-2-yl)-5,6,7,8-tetrahydronaphthalene-1-carbonitrile

Product 1

HCID 178510015HCID 178510015, compound

Sources & evidence

ORD record
ord-e7e5f9d477c54243b15c63cd4fa4bbbe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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