Ethanol → 9,10-Dihydro-10-(4-aminobenzoyl)-4H-pyrrolo[1,2-a]thieno[2,3-e][1,4]diazepine

HRID 2332428Notes

Reaction equation

HRID 2332428 reaction equation
[CH2:31]([OH:32])[CH3:33].[CH3:25][CH2:26][O:27][C:28](=[O:29])[CH3:30].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[n:13]([cH:20][cH:21][cH:22]3)[CH2:14][c:15]3[c:16]2[s:17][cH:18][cH:19]3)[cH:23][cH:24]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[n:13]([cH:20][cH:21][cH:22]3)[CH2:14][c:15]3[c:16]2[s:17][cH:18][cH:19]3)[cH:23][cH:24]1

Participants

4

Reactant 3

HCID 702EthanolHCID 8857Ethyl AcetateHCID 218371519,10-Dihydro-10-(4-nitrobenzoyl)-4H-pyrrolo[1,2-a]thieno[2,3-e][1,4]diazepine

Product 1

HCID 218371419,10-Dihydro-10-(4-aminobenzoyl)-4H-pyrrolo[1,2-a]thieno[2,3-e][1,4]diazepine

Sources & evidence

ORD record
ord-0d3545e78a2c4719b5bdfbeef22e219b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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