Chloroform → 3-(2-[(3-bromobenzyl)sulphanyl]-5-{[4-(1-pyrrolidinyl)-1-piperidinyl]carbonyl}-1H-benzimidazol-1-yl)-N-methyl-N-[2-(2-pyridinyl)ethyl]-1-propanamine

HRID 1237233Notes

Reaction equation

HRID 1237233 reaction equation
[Br:13][c:14]1[cH:15][c:16]([CH2:17][S:18][c:19]2[n:20][c:21]3[c:22]([n:23]2[CH2:24][CH2:25][CH2:26][N:27]([CH2:28][CH2:29][c:30]2[n:31][cH:32][cH:33][cH:34][cH:35]2)[CH3:36])[cH:37][cH:38][c:39]([C:41](=[O:42])[OH:43])[cH:40]3)[cH:44][cH:45][cH:46]1.[C:1]([c:2]1[nH:3][cH:4][cH:5][n:6]1)([c:7]1[nH:8][cH:9][cH:10][n:11]1)=[O:12].[CH3:62][N:63]([CH3:64])[CH:65]=[O:66].[CH:58]([Cl:59])([Cl:60])[Cl:61].[Cl:72][CH2:73][Cl:74].[N:47]1([CH:52]2[CH2:53][CH2:54][NH:55][CH2:56][CH2:57]2)[CH2:48][CH2:49][CH2:50][CH2:51]1.[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1>>[Br:13][c:14]1[cH:15][c:16]([CH2:17][S:18][c:19]2[n:20][c:21]3[c:22]([n:23]2[CH2:24][CH2:25][CH2:26][N:27]([CH2:28][CH2:29][c:30]2[n:31][cH:32][cH:33][cH:34][cH:35]2)[CH3:36])[cH:37][cH:38][c:39]([C:41](=[O:42])[N:55]2[CH2:54][CH2:53][CH:52]([N:47]4[CH2:48][CH2:49][CH2:50][CH2:51]4)[CH2:57][CH2:56]2)[cH:40]3)[cH:44][cH:45][cH:46]1

Participants

8

Reactant 7

HCID 6212ChloroformHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 787034-(1-Pyrrolidinyl)piperidineHCID 5250894Bis-(1H-imidazol-2-YL)-methanoneHCID 690294842-[(3-bromobenzyl)thio]-1-{3-[methyl(2-pyridin-2-ylethyl)amino]propyl}-1H-benzimidazole-5-carboxylic acid

Product 1

HCID 575676493-(2-[(3-bromobenzyl)sulphanyl]-5-{[4-(1-pyrrolidinyl)-1-piperidinyl]carbonyl}-1H-benzimidazol-1-yl)-N-methyl-N-[2-(2-pyridinyl)ethyl]-1-propanamine

Sources & evidence

ORD record
ord-90ae3c7518784572bac7142b1fa8092c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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