Heptane, 1-isothiocyanato- → HCID 21427832, compound

HRID 298086

Reaction equation

HRID 298086 reaction equation
[CH2:12]([CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH3:18])[N:19]=[C:20]=[S:21].[CH:1](=[O:2])[NH:3][NH:4][c:5]1[cH:6][cH:7][c:8]([NH2:11])[cH:9][cH:10]1>>[CH:1](=[O:2])[NH:3][NH:4][c:5]1[cH:6][cH:7][c:8]([NH:11][C:20]([NH:19][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH3:18])=[S:21])[cH:9][cH:10]1

Participants

3

Sources & evidence

ORD record
ord-aa9f5fe2525c40eab6e4ddb5d39f8f4f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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