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1,2-Dichloroethane → 3-[6-amino-5-(2-hydroxypropan-2-yl)-3-pyridinyl]-N-methyl-N-[(1-methylindol-2-yl)methyl]prop-2-enamide

HRID 1544478
Notes
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Reaction equation

HRID 1544478 reaction equation
[CH2:1]([Cl:2])[CH2:3][Cl:4].[CH3:32][NH:33][CH2:34][c:35]1[n:36]([CH3:44])[c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2[cH:43]1.[ClH:5].[NH2:6][c:7]1[c:8]([C:18]([CH3:19])([CH3:20])[OH:21])[cH:9][c:10]([CH:13]=[CH:14][C:15](=[O:16])[OH:17])[cH:11][n:12]1.[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH2:50].[OH:22][n:23]1[c:24]2[c:25]([cH:26][cH:27][cH:28][cH:29]2)[n:30][n:31]1>>[NH2:6][c:7]1[c:8]([C:18]([CH3:19])([CH3:20])[OH:21])[cH:9][c:10]([CH:13]=[CH:14][C:15](=[O:17])[N:33]([CH3:32])[CH2:34][c:35]2[n:36]([CH3:44])[c:37]3[cH:38][cH:39][cH:40][cH:41][c:42]3[cH:43]2)[cH:11][n:12]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 11401058methyl((1-methyl-1H-indol-2-yl)methyl)amineHCID 669670823-[6-Amino-5-(2-hydroxypropan-2-yl)-3-pyridinyl]prop-2-enoic acid

Product 1

HCID 669672093-[6-amino-5-(2-hydroxypropan-2-yl)-3-pyridinyl]-N-methyl-N-[(1-methylindol-2-yl)methyl]prop-2-enamide

Sources & evidence

ORD record
ord-e32b6ac9e3354e99ab4eb711df897e69
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes