Chloride → HCID 18475704, compound

HRID 1237002Notes

Reaction equation

HRID 1237002 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16]1.[CH2:47]([Cl:48])[Cl:49].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[Cl-:17].[NH2:18][CH:19]1[CH2:20][c:21]2[c:22]([N:29]3[CH2:30][CH2:31][N:32]([CH3:35])[CH2:33][CH2:34]3)[cH:23][cH:24][cH:25][c:26]2[CH2:27][CH2:28]1.[S:43]([Cl:44])([Cl:45])=[O:46]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([C:12](=[O:14])[NH:18][CH:19]2[CH2:20][c:21]3[c:22]([N:29]4[CH2:30][CH2:31][N:32]([CH3:35])[CH2:33][CH2:34]4)[cH:23][cH:24][cH:25][c:26]3[CH2:27][CH2:28]2)[cH:15][cH:16]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 24386Thionyl ChlorideHCID 1364294-Benzylbenzoic acidHCID 186225218-(4-Methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-amine

Product 1

HCID 18475704HCID 18475704, compound

Sources & evidence

ORD record
ord-4803b8230589406f816a5fe3e9223916
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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