Chloride → HCID 178428738, compound

HRID 1564419Notes

Reaction equation

HRID 1564419 reaction equation
[CH3:22][c:23]1[c:24]([N:32]=[C:33]=[S:34])[cH:25][cH:26][c:27]([N+:29](=[O:30])[O-:31])[cH:28]1.[Cl-:11].[Cl-:35].[Cl:12][CH2:13][CH:14]([NH3+:15])[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[Cl:36][CH2:37][CH:38]([NH3+:39])[CH2:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[c:1]1([CH:7]([CH2:8][OH:9])[NH2:10])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH2:8][S:34][C:33](=[N:32][c:24]3[c:23]([CH3:22])[cH:28][c:27]([N+:29](=[O:30])[O-:31])[cH:26][cH:25]3)[NH:10]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 312Chloride2×HCID 924662-Amino-2-phenylethanolHCID 1456212-Methyl-4-nitrophenyl isothiocyanateHCID 23262400HCID 23262400, compoundHCID 178514201HCID 178514201, compound

Product 1

HCID 178428738HCID 178428738, compound

Sources & evidence

ORD record
ord-c3e8efb0f10c491a935e11ec4f55e41b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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