Acetonitrile → 3-Ethyl-pentanoic acid (2,6-dimethyl-4-morpholin-4-yl-phenyl)-amide

HRID 114766

Reaction equation

HRID 114766 reaction equation
[CH2:1]([CH3:2])[CH:3]([CH2:4][C:5](=[O:6])[OH:7])[CH2:8][CH3:9].[CH3:14][c:15]1[c:16]([NH2:28])[c:17]([CH3:27])[cH:18][c:19]([N:21]2[CH2:22][CH2:23][O:24][CH2:25][CH2:26]2)[cH:20]1.[CH3:29][C:30]#[N:31].[S:10]([Cl:11])([Cl:12])=[O:13]>>[CH2:1]([CH3:2])[CH:3]([CH2:4][C:5](=[O:7])[NH:28][c:16]1[c:15]([CH3:14])[cH:20][c:19]([N:21]2[CH2:22][CH2:23][O:24][CH2:25][CH2:26]2)[cH:18][c:17]1[CH3:27])[CH2:8][CH3:9]

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 24386Thionyl ChlorideHCID 1344603-Ethylpentanoic acidHCID 230094142,6-Dimethyl-4-morpholin-4-yl-phenylamine

Product 1

HCID 116668733-Ethyl-pentanoic acid (2,6-dimethyl-4-morpholin-4-yl-phenyl)-amide

Sources & evidence

ORD record
ord-0ba2760934694ab287d50d21bd68d726
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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