1,1-Dichloroethane → N-(7-chloro-2,3-dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl)-N'-[4-(dimethylamino)-1-naphthalenyl]-thiourea

HRID 2142910Notes

Reaction equation

HRID 2142910 reaction equation
[Cl:38][CH:39]([Cl:40])[CH3:41].[N:22](=[C:23]=[S:24])[c:25]1[cH:26][cH:27][c:28]([N:35]([CH3:36])[CH3:37])[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]12.[NH2:1][CH:2]1[C:3](=[O:21])[N:4]([CH3:20])[c:5]2[c:6]([cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[C:7]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)=[N:8]1>>[NH:1]([CH:2]1[C:3](=[O:21])[N:4]([CH3:20])[c:5]2[c:6]([cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[C:7]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)=[N:8]1)[C:23]([NH:22][c:25]1[cH:26][cH:27][c:28]([N:35]([CH3:36])[CH3:37])[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]12)=[S:24]

Participants

4

Reactant 3

HCID 63651,1-DichloroethaneHCID 1224654-Isothiocyanato-N,N-dimethyl-1-naphthalenamineHCID 221352663-amino-7-chloro-1,3-dihydro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one

Product 1

HCID 10218116N-(7-chloro-2,3-dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl)-N'-[4-(dimethylamino)-1-naphthalenyl]-thiourea

Sources & evidence

ORD record
ord-01e180e2712d4b87af0470fe62a3e311
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…