3-Chlorobenzo(b)thiophene-2-carbonyl chloride → tert-Butyl {4-[(4'-carbamoyl-4-methoxy-biphenyl-3-ylmethyl)-(3-chloro-benzo[b]thiophene-2-carbonyl)-amino]-cyclohexyl}-methyl-carbamate

HRID 186749

Reaction equation

HRID 186749 reaction equation
[C:1]([NH2:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][c:12]([CH2:18][NH:19][CH:20]3[CH2:21][CH2:22][CH:23]([N:26]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH3:34])[CH2:24][CH2:25]3)[c:13]([O:16][CH3:17])[cH:14][cH:15]2)[cH:8][cH:9]1.[Cl:35][c:36]1[c:37]2[c:38]([s:39][c:40]1[C:41](=[O:42])[Cl:43])[cH:44][cH:45][cH:46][cH:47]2>>[C:1]([NH2:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][c:12]([CH2:18][N:19]([CH:20]3[CH2:21][CH2:22][CH:23]([N:26]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH3:34])[CH2:24][CH2:25]3)[C:41]([c:40]3[c:36]([Cl:35])[c:37]4[c:38]([s:39]3)[cH:44][cH:45][cH:46][cH:47]4)=[O:42])[c:13]([O:16][CH3:17])[cH:14][cH:15]2)[cH:8][cH:9]1

Participants

3

Reactant 2

HCID 5198983-Chlorobenzo(b)thiophene-2-carbonyl chlorideHCID 59683480tert-Butyl {4-[(4'-carbamoyl-4-methoxy-biphenyl-3-ylmethyl)-amino]-cyclohexyl}-methyl-carbamate

Product 1

HCID 59683502tert-Butyl {4-[(4'-carbamoyl-4-methoxy-biphenyl-3-ylmethyl)-(3-chloro-benzo[b]thiophene-2-carbonyl)-amino]-cyclohexyl}-methyl-carbamate

Sources & evidence

ORD record
ord-1838c3da3e79443296045506b00c9d56
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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