Dichloromethane → Methyl 4-(4-Methoxybenzenesulfonyl)-2,3,4,5-tetrahydro-1H-[1,4]benzodiazepine-3-carboxylate

HRID 100119Notes

Reaction equation

HRID 100119 reaction equation
[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[Cl:35][C:36]([O:37][CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)=[O:45].[Cl:46][CH2:47][Cl:48].[NH2:1][c:2]1[c:3]([CH2:4][N:5]([CH:6]([C:7](=[O:8])[O:9][CH3:10])[CH2:11][OH:12])[S:13](=[O:14])(=[O:15])[c:16]2[cH:17][cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]2)[cH:24][cH:25][cH:26][cH:27]1>>[NH:1]1[c:2]2[c:3]([cH:24][cH:25][cH:26][cH:27]2)[CH2:4][N:5]([S:13](=[O:14])(=[O:15])[c:16]2[cH:17][cH:18][c:19]([O:22][CH3:23])[cH:20][cH:21]2)[CH:6]([C:7](=[O:8])[O:9][CH3:10])[CH2:11]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 10387Benzyl chloroformateHCID 18612758Methyl [(2-aminobenzyl)-(4-methoxybenzenesulfonyl)amino]-3-hydroxypropionate

Product 1

HCID 18612753Methyl 4-(4-Methoxybenzenesulfonyl)-2,3,4,5-tetrahydro-1H-[1,4]benzodiazepine-3-carboxylate

Sources & evidence

ORD record
ord-d1561a4034cc48459cfbc7a050359539
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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