Potassium Cation → 4-{[(2-Nitrobenzenesulfonyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amino]-methyl}-N-pyridin-2-ylmethyl-benzamide

HRID 2128631Notes

Reaction equation

HRID 2128631 reaction equation
[CH3:48][C:49]#[N:50].[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[Cl:24][CH2:25][c:26]1[cH:27][cH:28][c:29]([C:30](=[O:31])[NH:32][CH2:33][c:34]2[n:35][cH:36][cH:37][cH:38][cH:39]2)[cH:40][cH:41]1.[K+:42].[K+:43].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10](=[O:11])(=[O:12])[NH:13][CH:14]2[CH2:15][CH2:16][CH2:17][c:18]3[cH:19][cH:20][cH:21][n:22][c:23]32)[cH:6][cH:7][cH:8][cH:9]1.[O-:44][C:45]([O-:46])=[O:47]>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10](=[O:11])(=[O:12])[N:13]([CH:14]2[CH2:15][CH2:16][CH2:17][c:18]3[cH:19][cH:20][cH:21][n:22][c:23]32)[CH2:25][c:26]2[cH:27][cH:28][c:29]([C:30](=[O:31])[NH:32][CH2:33][c:34]3[n:35][cH:36][cH:37][cH:38][cH:39]3)[cH:40][cH:41]2)[cH:6][cH:7][cH:8][cH:9]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 226012774-Chloromethyl-N-pyridin-2-ylmethyl-benzamideHCID 226013948-(2-Nitrobenzenesulfonyl)amino-5,6,7,8-tetrahydroquinoline

Product 1

HCID 226013714-{[(2-Nitrobenzenesulfonyl)-(5,6,7,8-tetrahydro-quinolin-8-yl)-amino]-methyl}-N-pyridin-2-ylmethyl-benzamide

Sources & evidence

ORD record
ord-00a7081aab054691a20da4110a27113b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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