1,4-Dioxane → 7-[(2,4-Dichloro-5-methoxyphenyl)amino]-2-[5-(1,3-dioxolan-2-yl)thien-3-yl]thieno[3,2-b]pyridine-6-carbonitrile

HRID 177455Notes

Reaction equation

HRID 177455 reaction equation
[CH2:24]([Sn:25]([CH2:26][CH2:27][CH2:28][CH3:39])([c:29]1[cH:30][s:31][c:32]([CH:34]2[O:35][CH2:36][CH2:37][O:38]2)[cH:33]1)[CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH3:46].[Cl:1][c:2]1[c:3]([NH:11][c:12]2[c:13]3[c:14]([n:15][cH:16][c:17]2[C:18]#[N:19])[cH:20][c:21]([I:23])[s:22]3)[cH:4][c:5]([O:9][CH3:10])[c:6]([Cl:8])[cH:7]1.[O:47]1[CH2:48][CH2:49][O:50][CH2:51][CH2:52]1>>[Cl:1][c:2]1[c:3]([NH:11][c:12]2[c:13]3[c:14]([n:15][cH:16][c:17]2[C:18]#[N:19])[cH:20][c:21](-[c:29]2[cH:30][s:31][c:32]([CH:34]4[O:35][CH2:36][CH2:37][O:38]4)[cH:33]2)[s:22]3)[cH:4][c:5]([O:9][CH3:10])[c:6]([Cl:8])[cH:7]1

Participants

4

Reactant 3

HCID 312751,4-DioxaneHCID 103902087-[(2,4-Dichloro-5-methoxyphenyl)amino]-2-iodothieno[3,2-b]pyridine-6-carbonitrileHCID 22256614Tributyl-(5-[1,3]dioxolan-2-yl-thiophen-3-yl)-stannane

Product 1

HCID 222566327-[(2,4-Dichloro-5-methoxyphenyl)amino]-2-[5-(1,3-dioxolan-2-yl)thien-3-yl]thieno[3,2-b]pyridine-6-carbonitrile

Sources & evidence

ORD record
ord-49609280338d449c8ab785a2696d6ea3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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