5-Isocyanatoisoquinoline → HCID 22032639, compound

HRID 1238148Notes

Reaction equation

HRID 1238148 reaction equation
[N:17](=[C:18]=[O:19])[c:20]1[c:21]2[cH:22][c:23]([CH3:30])[n:24][cH:25][c:26]2[cH:27][cH:28][cH:29]1.[N:1]1([c:9]2[cH:10][cH:11][c:12]([CH2:13][NH2:14])[cH:15][cH:16]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]1.[N:31]([c:32]1[cH:33][cH:34][cH:35][c:36]2[c:37]1[cH:38][cH:39][n:40][cH:41]2)=[C:42]=[O:43]>>[N:1]1([c:9]2[cH:10][cH:11][c:12]([CH2:13][NH:14][C:18]([NH:17][c:20]3[c:21]4[cH:22][c:23]([CH3:30])[n:24][cH:25][c:26]4[cH:27][cH:28][cH:29]3)=[O:19])[cH:15][cH:16]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]1

Participants

4

Sources & evidence

ORD record
ord-3d838a65a9ff4610a6d013bb6af13c3a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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