Acetonitrile → HCID 66662500, compound

HRID 1131716Notes

Reaction equation

HRID 1131716 reaction equation
[CH3:33][C:34]#[N:35].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][S:44]([Cl:45])(=[O:46])=[O:47].[O:1]=[C:2]1[N:3]([c:8]2[cH:9][cH:10][c:11]([C:14]3([C:17](=[O:18])[N:19]4[CH2:20][C:21]5([O:22][C:23](=[O:30])[c:24]6[c:25]5[cH:26][cH:27][cH:28][cH:29]6)[CH2:31][CH2:32]4)[CH2:15][CH2:16]3)[cH:12][cH:13]2)[CH2:4][CH2:5][NH:6][CH2:7]1>>[O:1]=[C:2]1[N:3]([c:8]2[cH:9][cH:10][c:11]([C:14]3([C:17](=[O:18])[N:19]4[CH2:20][C:21]5([O:22][C:23](=[O:30])[c:24]6[c:25]5[cH:26][cH:27][cH:28][cH:29]6)[CH2:31][CH2:32]4)[CH2:15][CH2:16]3)[cH:12][cH:13]2)[CH2:4][CH2:5][N:6]([S:44]([CH3:43])(=[O:46])=[O:47])[CH2:7]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 31297Methanesulfonyl chlorideHCID 178519042HCID 178519042, compound

Product 1

HCID 66662500HCID 66662500, compound

Sources & evidence

ORD record
ord-bd24a2d84ae0468d8b528dc66c72800f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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