Ethanol → HCID 178480164, compound

HRID 691017Notes

Reaction equation

HRID 691017 reaction equation
[CH3:1][N:2]1[CH:3]([CH2:7][CH2:8][N:9]2[c:10]3[c:11]([cH:15][c:16]([NH2:19])[cH:17][cH:18]3)[S:12][CH2:13][CH2:14]2)[CH2:4][CH2:5][CH2:6]1.[CH3:30][CH2:31][OH:32].[IH:20].[s:21]1[c:22]([C:26](=[NH:27])[S:28][CH3:29])[cH:23][cH:24][cH:25]1>>[CH3:1][N:2]1[CH:3]([CH2:7][CH2:8][N:9]2[c:10]3[c:11]([cH:15][c:16]([NH:19][C:26]([c:22]4[s:21][cH:25][cH:24][cH:23]4)=[NH:27])[cH:17][cH:18]3)[S:12][CH2:13][CH2:14]2)[CH2:4][CH2:5][CH2:6]1

Participants

5

Sources & evidence

ORD record
ord-d9e38006252143a5b2b1aec54a510914
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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