Acetonitrile → HCID 178431267, compound

HRID 113851Notes

Reaction equation

HRID 113851 reaction equation
[CH2:32]([Cl:33])[Cl:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:47][C:48]#[N:49].[CH:1]1([NH:10][c:11]2[c:12]3[n:13][cH:14][n:15]([CH:20]4[CH2:21][CH:22]([CH2:30][OH:31])[CH:23]5[CH:24]4[O:25][C:26]([CH3:28])([CH3:29])[O:27]5)[c:16]3[n:17][cH:18][n:19]2)[CH2:2][CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21.[Cl:42][S:43](=[O:44])(=[O:45])[NH2:46]>>[CH:1]1([NH:10][c:11]2[c:12]3[n:13][cH:14][n:15]([CH:20]4[CH2:21][CH:22]([CH2:30][O:31][S:43](=[O:44])(=[O:45])[NH2:46])[CH:23]5[CH:24]4[O:25][C:26]([CH3:28])([CH3:29])[O:27]5)[c:16]3[n:17][cH:18][n:19]2)[CH2:2][CH2:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]21

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 6344DichloromethaneHCID 8471TriethylamineHCID 24499Chlorosulfamic acidHCID 67164592[4-[6-(2,3-dihydro-1H-inden-1-ylamino)purin-9-yl]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-6-yl]methanol

Product 1

HCID 178431267HCID 178431267, compound

Sources & evidence

ORD record
ord-b4f7a4163b8c42c5a1684be8c5b002ee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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