Dimethyl Sulfoxide → N-(3-{3-[(2-Oxo-2,3,7,8-Tetrahydro-1H-6,9-Dioxa-1,3-Diaza-Cyclopenta[a]Naphthalen-8-Ylmethyl)-Amino]-Propoxy}-Phenyl)-Acetamide

HRID 1570195Notes

Reaction equation

HRID 1570195 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:12][CH:13]2[CH2:14][O:15][c:16]3[c:17]([c:18]4[c:19]([nH:20][c:21](=[O:23])[nH:22]4)[cH:24][cH:25]3)[O:26]2)(=[O:8])=[O:9])[cH:10][cH:11]1.[CH3:42][S:43]([CH3:44])=[O:45].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[NH2:27][CH2:28][CH2:29][CH2:30][O:31][c:32]1[cH:33][c:34]([NH:38][C:39]([CH3:40])=[O:41])[cH:35][cH:36][cH:37]1>>[CH2:12]([CH:13]1[CH2:14][O:15][c:16]2[c:17]([c:18]3[c:19]([nH:20][c:21](=[O:23])[nH:22]3)[cH:24][cH:25]2)[O:26]1)[NH:27][CH2:28][CH2:29][CH2:30][O:31][c:32]1[cH:33][c:34]([NH:38][C:39]([CH3:40])=[O:41])[cH:35][cH:36][cH:37]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 8857Ethyl AcetateHCID 2735413N-[3-(3-aminopropoxy)phenyl]acetamideHCID 102929161,3,7,8-Tetrahydro-8-[[[(4-Methylphenyl)Sulfonyl]Oxy]Methyl]-2H-[1,4]Dioxino[2,3-e]Benzimidazol-2-One

Product 1

HCID 10136384N-(3-{3-[(2-Oxo-2,3,7,8-Tetrahydro-1H-6,9-Dioxa-1,3-Diaza-Cyclopenta[a]Naphthalen-8-Ylmethyl)-Amino]-Propoxy}-Phenyl)-Acetamide

Sources & evidence

ORD record
ord-81ba94de559f4f048d456d020cd0b5f0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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