Hydrochloric Acid → N-(3-chloro-4-(3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl) [1,2,4]triazol-5-ylmethyl)indole-2-carboxamide

HRID 311631Notes

Reaction equation

HRID 311631 reaction equation
[CH:42]([Cl:43])([Cl:44])[Cl:45].[Cl:1][c:2]1[n:3][n:4][c:5]2[n:6]1-[c:7]1[c:8]([cH:19][c:20]([CH2:22][CH3:23])[s:21]1)[C:9]([c:12]1[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]1)=[N:10][CH2:11]2.[ClH:24].[Na+:25].[OH:26][C:27](=[O:28])[O-:29].[nH:30]1[c:31]([C:39](=[O:40])[Cl:41])[cH:32][c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]12>>[Cl:1][c:2]1[n:3][n:4][c:5]([CH2:11][NH:10][C:39]([c:31]2[nH:30][c:38]3[c:33]([cH:32]2)[cH:34][cH:35][cH:36][cH:37]3)=[O:40])[n:6]1-[c:7]1[c:8]([C:9]([c:12]2[c:13]([Cl:18])[cH:14][cH:15][cH:16][cH:17]2)=[O:26])[cH:19][c:20]([CH2:22][CH3:23])[s:21]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6212ChloroformHCID 118162081H-indole-2-carbonyl ChlorideHCID 677277459-chloro-4-(2-chlorophenyl)-2-ethyl-6H-thieno[3,2-f] [1,2,4]triazolo[4,3-a] [1,4]diazepine

Product 1

HCID 67727760N-(3-chloro-4-(3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl) [1,2,4]triazol-5-ylmethyl)indole-2-carboxamide

Sources & evidence

ORD record
ord-cb62b025780e43228f6cc2483fcb1660
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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