10,11-Dihydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepine → (10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-yl)-[4-(3,4-dihydro-naphthalen-1-yl)-3-methyl-phenyl]-methanone

HRID 1127569Notes

Reaction equation

HRID 1127569 reaction equation
[C:1]1([c:11]2[c:12]([CH3:20])[cH:13][c:14]([C:15](=[O:16])[OH:17])[cH:18][cH:19]2)=[CH:2][CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21.[cH:21]1[cH:22][cH:23][n:24]2[c:25]1[CH2:26][NH:27][c:28]1[c:29]([cH:31][cH:32][cH:33][cH:34]1)[CH2:30]2>>[C:1]1([c:11]2[c:12]([CH3:20])[cH:13][c:14]([C:15](=[O:16])[N:27]3[CH2:26][c:25]4[cH:21][cH:22][cH:23][n:24]4[CH2:30][c:29]4[c:28]3[cH:34][cH:33][cH:32][cH:31]4)[cH:18][cH:19]2)=[CH:2][CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21

Participants

3

Reactant 2

HCID 1554704810,11-Dihydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepineHCID 222197044-(3,4-Dihydro-naphthalen-1-yl)-3-methyl-benzoic acid

Product 1

HCID 9867363(10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-yl)-[4-(3,4-dihydro-naphthalen-1-yl)-3-methyl-phenyl]-methanone

Sources & evidence

ORD record
ord-f4d6bc76030b4100982dc838fef9464d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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