Dimethyl Sulfoxide → HCID 54514832, compound

HRID 2137482Notes

Reaction equation

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]2[c:11]3[cH:12][c:13]4[nH:14][c:15]([CH3:23])[n:16][c:17]4[cH:18][c:19]3[CH:20]([CH2:21]1)[CH2:22]2.[CH3:24][S:25]([CH3:26])=[O:27].[CH3:35][OH:36].[Cl:37][CH2:38][Cl:39].[I:28][CH2:29][CH2:30][CH3:31].[Na+:34].[OH-:33].[OH2:32]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]2[c:11]3[cH:12][c:13]4[n:14][c:15]([CH3:23])[n:16]([CH2:29][CH2:30][CH3:31])[c:17]4[cH:18][c:19]3[CH:20]([CH2:21]1)[CH2:22]2

Participants

Reactant 8

HCID 679Dimethyl Sulfoxide

HCID 6344Dichloromethane

HCID 336431-Iodopropane

HCID 543110386-Methyl-5,7,13-triazatetracyclo[9.3.1.02,10.04,8]pentadeca-2(10),3,5,8-tetraene-13-carboxylic acid tert-butyl ester

Product 1

HCID 54514832HCID 54514832, compound

Sources & evidence

ORD record: ord-de7decc2c82a424896a9c7ceb66a9785
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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