Acetic Acid → HCID 21289507, compound

HRID 1535509Notes

Reaction equation

HRID 1535509 reaction equation
[CH3:33][C:34]#[N:35].[CH3:36][C:37](=[O:38])[OH:39].[Cl-:1].[ClH:32].[N:2]([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])=[O:8].[NH2:9][c:10]1[s:11][c:12]([CH2:15][CH2:16][CH:17]2[c:18]3[cH:19][cH:20][cH:21][c:22]([C:27](=[O:28])[O:29][CH2:30][CH3:31])[c:23]3[CH2:24][CH2:25][CH2:26]2)[cH:13][n:14]1.[Zn:40]>>[cH:10]1[s:11][c:12]([CH2:15][CH2:16][CH:17]2[c:18]3[cH:19][cH:20][cH:21][c:22]([C:27](=[O:28])[O:29][CH2:30][CH3:31])[c:23]3[CH2:24][CH2:25][CH2:26]2)[cH:13][n:14]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 312ChlorideHCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 10906Tert-Butyl nitriteHCID 23994ZincHCID 21289480HCID 21289480, compound

Product 1

HCID 21289507HCID 21289507, compound

Sources & evidence

ORD record
ord-0a97ee72df6244759428ada619dd898f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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