Phenyl Isothiocyanate → 1-Phenyl-3-[4-(phenylsulfamoyl)phenyl]thiourea

HRID 1566490

Reaction equation

HRID 1566490 reaction equation
[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[NH2:17][c:18]1[cH:19][cH:20][c:21]([S:24](=[O:25])(=[O:26])[NH:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:22][cH:23]1.[c:8]1([N:14]=[C:15]=[S:16])[cH:9][cH:10][cH:11][cH:12][cH:13]1>>[c:8]1([NH:14][C:15](=[S:16])[NH:17][c:18]2[cH:19][cH:20][c:21]([S:24](=[O:25])(=[O:26])[NH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:22][cH:23]2)[cH:9][cH:10][cH:11][cH:12][cH:13]1

Participants

5

Reactant 4

HCID 7673Phenyl IsothiocyanateHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 31390Sulfabenz

Product 1

HCID 34210331-Phenyl-3-[4-(phenylsulfamoyl)phenyl]thiourea

Sources & evidence

ORD record
ord-12d414b8dbdb40baa5c48f3020567716
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Linked notes

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