Ethyl Acetate → HCID 12018680, compound

HRID 2155632Notes

Reaction equation

HRID 2155632 reaction equation
[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[H:33][H:34].[c:1]1([CH3:32])[cH:2][cH:3][c:4](-[n:7]2[n:8][c:9](-[c:13]3[cH:14][cH:15][c:16]([NH:19][S:20](=[O:21])(=[O:22])[c:23]4[cH:24][cH:25][c:26]([N+:29]([O-:30])=[O:31])[cH:27][cH:28]4)[cH:17][cH:18]3)[cH:10][c:11]2[NH2:12])[cH:5][cH:6]1>>[c:1]1([CH3:32])[cH:2][cH:3][c:4](-[n:7]2[n:8][c:9](-[c:13]3[cH:14][cH:15][c:16]([NH:19][S:20](=[O:21])(=[O:22])[c:23]4[cH:24][cH:25][c:26]([NH2:29])[cH:27][cH:28]4)[cH:17][cH:18]3)[cH:10][c:11]2[NH2:12])[cH:5][cH:6]1

Participants

4

Reactant 3

HCID 8857Ethyl AcetateHCID 12018679HCID 12018679, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 12018680HCID 12018680, compound

Sources & evidence

ORD record
ord-872759ba2fcb4b3982adb4c073cc3c14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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