Dichloromethane → HCID 66711180, compound

HRID 197922Notes

Reaction equation

HRID 197922 reaction equation
[CH3:1][S:2](=[O:3])[c:4]1[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[CH3:22])[cH:17][cH:18]1.[CH3:38][N:39]1[CH2:40][CH2:41][CH2:42][C:43]1=[O:44].[Cl:45][CH2:46][Cl:47].[NH2:23][c:24]1[cH:25][cH:26][c:27]([N:30]2[CH2:31][CH2:32][CH:33]([CH2:36][OH:37])[CH2:34][CH2:35]2)[cH:28][cH:29]1>>[c:4]1([NH:23][c:24]2[cH:25][cH:26][c:27]([N:30]3[CH2:31][CH2:32][CH:33]([CH2:36][OH:37])[CH2:34][CH2:35]3)[cH:28][cH:29]2)[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[CH3:22])[cH:17][cH:18]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 13387N-methyl-2-pyrrolidoneHCID 431331461-(4-Aminophenyl)-4-piperidinemethanolHCID 667110462-(Methylsulfinyl)-7-(4-(methylsulfonyl)phenyl)pyrrolo[2,1-f][1,2,4]triazine

Product 1

HCID 66711180HCID 66711180, compound

Sources & evidence

ORD record
ord-a5bb4da7537c408f9b34c3dfd8445afb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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