Dimethyl Sulfoxide → HCID 22508608, compound

HRID 2347106Notes

Reaction equation

HRID 2347106 reaction equation
[Br:1][c:2]1[n:3][c:4]2[n:5]([CH3:30])[c:6](=[O:29])[n:7]([CH2:20][c:21]3[c:22]([C:23]#[N:24])[cH:25][cH:26][cH:27][cH:28]3)[c:8](=[O:19])[c:9]2[n:10]1[CH2:11][c:12]1[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]1.[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:46][S:47]([CH3:48])=[O:49].[NH:31]1[CH2:32][CH:33]([NH2:38])[CH2:34][CH2:35][CH2:36][CH2:37]1>>[c:2]1([N:31]2[CH2:32][CH:33]([NH2:38])[CH2:34][CH2:35][CH2:36][CH2:37]2)[n:3][c:4]2[n:5]([CH3:30])[c:6](=[O:29])[n:7]([CH2:20][c:21]3[c:22]([C:23]#[N:24])[cH:25][cH:26][cH:27][cH:28]3)[c:8](=[O:19])[c:9]2[n:10]1[CH2:11][c:12]1[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 8471TriethylamineHCID 2756445Azepan-3-amineHCID 22508571HCID 22508571, compound

Product 1

HCID 22508608HCID 22508608, compound

Sources & evidence

ORD record
ord-7107af5b32994b4e83a851771d2a0376
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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