Acetic Acid → HCID 68468856, compound

HRID 2332538Notes

Reaction equation

HRID 2332538 reaction equation
[C:27]([OH:28])(=[O:29])[CH3:30].[Cl:1][c:2]1[c:3]([NH2:22])[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.[Cl:31][CH2:32][Cl:33].[NH2:23][C:24]([NH2:25])=[O:26]>>[Cl:1][c:2]1[c:3]([NH:22][C:24]([NH2:23])=[O:26])[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 176Acetic AcidHCID 1176UreaHCID 6344DichloromethaneHCID 231203012-Chloro-5-(2,3,4,5-tetrahydro-benzo[b]azepine-1-sulfonyl)-phenylamine

Product 1

HCID 68468856HCID 68468856, compound

Sources & evidence

ORD record
ord-472b253dc5b94526b0c553910c145618
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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