Isopropanol → HCID 67342224, compound

HRID 1148220Notes

Reaction equation

HRID 1148220 reaction equation
[CH2:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[N:30]1[CH2:31][CH:32]([NH2:36])[CH2:33][CH2:34][CH2:35]1.[CH3:46][CH:47]([OH:48])[CH3:49].[CH:37]([N:38]([CH:39]([CH3:40])[CH3:41])[CH2:42][CH3:43])([CH3:44])[CH3:45].[Cl:50][CH2:51][Cl:52].[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[c:18]3[Cl:19])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][cH:12][c:13]3[c:14]2[n:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[c:18]3[NH:36][CH:32]2[CH2:31][N:30]([CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[CH2:35][CH2:34][CH2:33]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 3776IsopropanolHCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 4216941-Benzylpiperidin-3-amineHCID 583947741-(benzenesulfonyl)-4-chloro-5-nitro-1H-pyrrolo(2,3-b)pyridine

Product 1

HCID 67342224HCID 67342224, compound

Sources & evidence

ORD record
ord-d9f76ed82e134ebdb322c225e9ab9dd2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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