Toluene → HCID 13953700, compound

HRID 1232188Notes

Reaction equation

HRID 1232188 reaction equation
[CH3:30][O:31][c:32]1[cH:33][cH:34][c:35]([P:36]2(=[S:37])[S:38][P:40](=[S:41])([c:42]3[cH:43][cH:44][c:45]([O:46][CH3:47])[cH:48][cH:49]3)[S:39]2)[cH:50][cH:51]1.[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[c:1]1([C:7]2=[N:8][CH:9]([NH:19][C:20]([O:21][CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)=[O:29])[C:10](=[O:18])[NH:11][c:12]3[c:13]2[cH:14][cH:15][cH:16][cH:17]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2=[N:8][CH:9]([NH:19][C:20]([O:21][CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)=[O:29])[C:10](=[S:39])[NH:11][c:12]3[c:13]2[cH:14][cH:15][cH:16][cH:17]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 87949Lawesson's reagentHCID 2756242Benzyl (2-oxo-5-phenyl-2,3-dihydro-1h-benzo[e][1,4]diazepin-3-yl)carbamate

Product 1

HCID 13953700HCID 13953700, compound

Sources & evidence

ORD record
ord-df73b901fddd4efca47a86a71ad91780
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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