Acetate → N-[2-chloro-5-(2,3,4,5-tetrahydro-benzo[b]azepine-1-sulfonyl)-phenyl]-3-imino-butyramide

HRID 1231141Notes

Reaction equation

HRID 1231141 reaction equation
[CH3:30][C:31](=[O:32])[O-:33].[CH3:34][CH2:35][OH:36].[Cl:1][c:2]1[c:3]([NH:22][C:23]([CH2:24][C:25]([CH3:26])=[O:27])=[O:28])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[c:12]3[c:13]([cH:18][cH:19][cH:20][cH:21]3)[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:6][cH:7]1.[NH4+:29]>>[Cl:1][c:2]1[c:3]([NH:22][C:23]([CH2:24][C:25]([CH3:26])=[NH:29])=[O:28])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[c:12]3[c:13]([cH:18][cH:19][cH:20][cH:21]3)[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 175AcetateHCID 223AmmoniumHCID 702EthanolHCID 86643503HCID 86643503, compound

Product 1

HCID 86643504N-[2-chloro-5-(2,3,4,5-tetrahydro-benzo[b]azepine-1-sulfonyl)-phenyl]-3-imino-butyramide

Sources & evidence

ORD record
ord-4a109af78ba946c482630393080e8c6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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