Acetone → HCID 59300829, compound

HRID 141446Notes

Reaction equation

HRID 141446 reaction equation
[CH3:31][C:32](=[O:33])[CH3:34].[NH2:1][c:2]1[n:3][c:4]2[c:5]([cH:6][c:7]3[c:11]([cH:12]2)[N:10]([CH2:13][CH2:14][CH2:15][CH2:16][CH3:17])[C:9](=[O:18])[C:8]3([CH3:19])[CH3:20])[nH:21]1.[O:22]=[C:23]=[N:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[NH:1]([c:2]1[n:3][c:4]2[c:5]([cH:6][c:7]3[c:11]([cH:12]2)[N:10]([CH2:13][CH2:14][CH2:15][CH2:16][CH3:17])[C:9](=[O:18])[C:8]3([CH3:19])[CH3:20])[nH:21]1)[C:23](=[O:22])[NH:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1

Participants

4

Reactant 3

HCID 180AcetoneHCID 7672Phenyl isocyanateHCID 593008242-Amino-7,7-dimethyl-5-pentyl-5,7-dihydro-1H-imidazo[4,5-f]indol-6-one

Product 1

HCID 59300829HCID 59300829, compound

Sources & evidence

ORD record
ord-5bf2681c65a442df9ecbacaa774dadbf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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