Hydrochloric Acid → 4-{[6-N-(Benzyloxycarbonyl)-adenin-9-yl]acetyl}-(2-nitro-benzenesulfonyl)-piperazin-2-one

HRID 1238910Notes

Reaction equation

HRID 1238910 reaction equation
[CH2:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[O:28][C:29](=[O:30])[NH:31][c:32]1[c:33]2[n:34][cH:35][n:36]([CH2:41][C:42](=[O:43])[OH:44])[c:37]2[n:38][cH:39][n:40]1.[ClH:20].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10](=[O:11])(=[O:12])[N:13]2[C:14](=[O:19])[CH2:15][NH:16][CH2:17][CH2:18]2)[cH:6][cH:7][cH:8][cH:9]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10](=[O:11])(=[O:12])[N:13]2[C:14](=[O:19])[CH2:15][N:16]([C:42]([CH2:41][n:36]3[cH:35][n:34][c:33]4[c:32]([NH:31][C:29]([O:28][CH2:21][c:22]5[cH:23][cH:24][cH:25][cH:26][cH:27]5)=[O:30])[n:40][cH:39][n:38][c:37]43)=[O:43])[CH2:17][CH2:18]2)[cH:6][cH:7][cH:8][cH:9]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 154805149H-Purine-9-acetic acid, 6-[[(phenylmethoxy)carbonyl]amino]-HCID 222223751-(2-Nitrophenyl)sulfonylpiperazin-2-one

Product 1

HCID 222224344-{[6-N-(Benzyloxycarbonyl)-adenin-9-yl]acetyl}-(2-nitro-benzenesulfonyl)-piperazin-2-one

Sources & evidence

ORD record
ord-a2f813a959be4f369dc82fe40639a6da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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