Isopropanol → HCID 178459606, compound

HRID 1216034Notes

Reaction equation

HRID 1216034 reaction equation
[CH3:40][CH:41]([CH3:42])[OH:43].[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH2:12][NH:13][C:14]([CH:15]3[N:16]([C:20]([CH:21]([CH2:22][CH:23]4[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]4)[NH:29][CH2:30][C:31](=[O:32])[OH:33])=[O:34])[CH2:17][CH2:18][CH2:19]3)=[O:35])[cH:9][cH:10][c:11]12.[S:36]([Cl:37])([Cl:38])=[O:39]>>[NH2:1][c:2]1[n:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH2:12][NH:13][C:14]([CH:15]3[N:16]([C:20]([CH:21]([CH2:22][CH:23]4[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]4)[NH:29][CH2:30][C:31](=[O:32])[O:33][CH:41]([CH3:40])[CH3:42])=[O:34])[CH2:17][CH2:18][CH2:19]3)=[O:35])[cH:9][cH:10][c:11]12

Participants

4

Reactant 3

HCID 3776IsopropanolHCID 24386Thionyl ChlorideHCID 70169494HCID 70169494, compound

Product 1

HCID 178459606HCID 178459606, compound

Sources & evidence

ORD record
ord-6bc1e183a5e14e56898ccd1ae56fe0d0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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