Ammonia → HCID 178443734, compound

HRID 2123351Notes

Reaction equation

HRID 2123351 reaction equation
[CH2:40]([OH:41])[CH2:42][CH3:43].[NH2:3][c:4]1[c:5]([S:10][c:11]2[c:12]([O:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[c:13]([C:29]#[N:30])[c:14]([C:15]#[N:16])[c:17]([O:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])[c:18]2[Cl:19])[cH:6][cH:7][cH:8][cH:9]1.[NH3:2].[Na:1]>>[NH:2]=[C:29]1[c:13]2[c:12]([O:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[c:11]([S:10][c:5]3[c:4]([NH2:3])[cH:9][cH:8][cH:7][cH:6]3)[c:18]([Cl:19])[c:17]([O:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28])[c:14]2[C:15](=[NH:16])[NH:30]1

Participants

5

Reactant 4

HCID 222AmmoniaHCID 10311-PropanolHCID 5360545SodiumHCID 18699144HCID 18699144, compound

Product 1

HCID 178443734HCID 178443734, compound

Sources & evidence

ORD record
ord-d91b875b7471451c969bb9323841ff47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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