Ethyl Acetate → HCID 53630454, compound

HRID 1135086Notes

Reaction equation

HRID 1135086 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[n:16][cH:17][n:18][c:19]([NH:24][c:25]3[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:29][cH:30]3)[c:20]2[N+:21]([O-:22])=[O:23])[CH2:12][CH2:13]1.[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[n:16][cH:17][n:18][c:19]([NH:24][c:25]3[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[CH3:34])[cH:29][cH:30]3)[c:20]2[NH2:21])[CH2:12][CH2:13]1

Participants

3

Reactant 2

HCID 8857Ethyl AcetateHCID 11397775HCID 11397775, compound

Product 1

HCID 53630454HCID 53630454, compound

Sources & evidence

ORD record
ord-4ea37a37794a4d4684fd865bacccb008
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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