Acetic Acid → HCID 22348062, compound

HRID 124597Notes

Reaction equation

HRID 124597 reaction equation
[CH3:50][C:51](=[O:52])[OH:53].[CH3:54][C:55]#[N:56].[Cl:42][N:43]1[C:44](=[O:45])[CH2:46][CH2:47][C:48]1=[O:49].[O:12]1[CH2:13][O:14][c:15]2[c:16]1[cH:17][cH:18][c:19]([CH2:21][N:22]1[CH2:23][CH2:24][CH:25]([NH:28][c:29]3[cH:30][c:31](=[O:41])[o:32][c:33]4[cH:34][cH:35][c:36]([O:39][CH3:40])[cH:37][c:38]34)[CH2:26][CH2:27]1)[cH:20]2.[c:1]1([CH3:2])[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1>>[O:12]1[CH2:13][O:14][c:15]2[c:16]1[cH:17][cH:18][c:19]([CH2:21][N:22]1[CH2:23][CH2:24][CH:25]([NH:28][c:29]3[c:30]([Cl:42])[c:31](=[O:41])[o:32][c:33]4[cH:34][cH:35][c:36]([O:39][CH3:40])[cH:37][c:38]34)[CH2:26][CH2:27]1)[cH:20]2

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 6101p-Toluenesulfonic acidHCID 6342AcetonitrileHCID 31398ChlorosuccinimideHCID 10070016HCID 10070016, compound

Product 1

HCID 22348062HCID 22348062, compound

Sources & evidence

ORD record
ord-9fc645366d9243a599ac0670332128e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…