Acetonitrile → HCID 58014938, compound

HRID 173428Notes

Reaction equation

HRID 173428 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[cH:11][cH:12][c:13]([NH:16][c:17]3[n:18][cH:19][c:20]([C:31](=[O:32])[NH2:33])[c:21]([NH:23][CH2:24][CH:25]4[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]4)[n:22]3)[cH:14][cH:15]2)[CH2:8][CH2:9]1.[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:41][C:42](=[O:43])[O:44][C:45](=[O:46])[CH3:47].[CH3:48][C:49]#[N:50]>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[cH:11][cH:12][c:13]([NH:16][c:17]3[n:18][cH:19][c:20]([C:31](=[O:32])[NH2:33])[c:21]([NH:23][CH2:24][CH:25]4[CH2:26][CH2:27][N:28]([C:42]([CH3:41])=[O:43])[CH2:29][CH2:30]4)[n:22]3)[cH:14][cH:15]2)[CH2:8][CH2:9]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 7918Acetic AnhydrideHCID 8471TriethylamineHCID 58014932HCID 58014932, compound

Product 1

HCID 58014938HCID 58014938, compound

Sources & evidence

ORD record
ord-4b31fa206367433582cd9090ab0eca44
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…