1-Butanol → HCID 178423752, compound

HRID 2151632Notes

Reaction equation

HRID 2151632 reaction equation
[CH2:42]([OH:43])[CH2:44][CH2:45][CH3:46].[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[NH2:1][CH:2]([CH3:3])[c:4]1[n:5](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:6](=[O:15])[c:7]2[c:8]([CH3:14])[cH:9][cH:10][cH:11][c:12]2[cH:13]1.[NH2:22][c:23]1[n:24][c:25]([Cl:32])[c:26]2[nH:27][cH:28][n:29][c:30]2[n:31]1>>[NH:1]([CH:2]([CH3:3])[c:4]1[n:5](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:6](=[O:15])[c:7]2[c:8]([CH3:14])[cH:9][cH:10][cH:11][c:12]2[cH:13]1)[c:25]1[n:24][c:23]([NH2:22])[n:31][c:30]2[c:26]1[n:27][cH:28][nH:29]2

Participants

5

Reactant 4

HCID 2631-ButanolHCID 81531DiisopropylethylamineHCID 53603492-Amino-6-chloropurineHCID 69033205HCID 69033205, compound

Product 1

HCID 178423752HCID 178423752, compound

Sources & evidence

ORD record
ord-ede7e9d012fe44c1abc488496dac2cf7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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