Acetonitrile → N-{3-[2-amino-6-(2-{[tert-butyl(dimethyl)silyl]oxy}phenyl)-3-cyano-4-pyridinyl]phenyl}-3-(1-piperidinyl)propanamide

HRID 304316

Reaction equation

HRID 304316 reaction equation
[CH3:51][C:52]#[N:53].[Cl:12][C:13]([C:14]([Cl:15])=[O:16])=[O:17].[Cl:48][CH2:49][Cl:50].[N:1]1([CH2:7][CH2:8][C:9](=[O:10])[OH:11])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[NH2:18][c:19]1[c:20]([C:21]#[N:22])[c:23](-[c:41]2[cH:42][c:43]([NH2:47])[cH:44][cH:45][cH:46]2)[cH:24][c:25](-[c:27]2[c:28]([O:33][Si:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[CH3:40])[cH:29][cH:30][cH:31][cH:32]2)[n:26]1>>[N:1]1([CH2:7][CH2:8][C:9](=[O:11])[NH:47][c:43]2[cH:42][c:41](-[c:23]3[c:20]([C:21]#[N:22])[c:19]([NH2:18])[n:26][c:25](-[c:27]4[c:28]([O:33][Si:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[CH3:40])[cH:29][cH:30][cH:31][cH:32]4)[cH:24]3)[cH:46][cH:45][cH:44]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 6344DichloromethaneHCID 65578Oxalyl chlorideHCID 1177821-Piperidinepropanoic acidHCID 597696742-Amino-4-(3-aminophenyl)-6-(2-{[tert-butyl(dimethyl)silyl]oxy}phenyl)nicotinonitrile

Product 1

HCID 69144979N-{3-[2-amino-6-(2-{[tert-butyl(dimethyl)silyl]oxy}phenyl)-3-cyano-4-pyridinyl]phenyl}-3-(1-piperidinyl)propanamide

Sources & evidence

ORD record
ord-ad46d90f7e4f472aa99cda6b67f6d9a0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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