Chloride → HCID 18475718, compound

HRID 2123630Notes

Reaction equation

HRID 2123630 reaction equation
[CH2:43]([Cl:44])[Cl:45].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[Cl-:13].[NH2:14][CH:15]1[CH2:16][c:17]2[c:18]([N:25]3[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]3)[cH:19][cH:20][cH:21][c:22]2[CH2:23][CH2:24]1.[S:39]([Cl:40])([Cl:41])=[O:42].[c:1]1([CH2:7][CH2:8][CH2:9][C:10](=[O:11])[OH:12])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][CH2:9][C:10](=[O:12])[NH:14][CH:15]2[CH2:16][c:17]3[c:18]([N:25]4[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]4)[cH:19][cH:20][cH:21][c:22]3[CH2:23][CH2:24]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 47754-Phenylbutyric AcidHCID 6344DichloromethaneHCID 8471TriethylamineHCID 24386Thionyl ChlorideHCID 186225218-(4-Methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-amine

Product 1

HCID 18475718HCID 18475718, compound

Sources & evidence

ORD record
ord-bcb8ae8d79a043e18cc9a0d7edb73eb7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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