Acetate → Erlotinib Acetate

HRID 1549116Notes

Reaction equation

HRID 1549116 reaction equation
[C:30]([CH3:31])(=[O:32])[O-:33].[Cl:2][CH2:3][CH2:4][O:5][c:6]1[c:7]([O:25][CH2:26][CH2:27][O:28][CH3:29])[cH:8][c:9]2[c:10]([NH:16][c:17]3[cH:18][c:19]([C:23]#[CH:24])[cH:20][cH:21][cH:22]3)[n:11][cH:12][n:13][c:14]2[cH:15]1.[ClH:1].[Cs+:34].[N:35]#[N:36].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41]>>[CH2:3]([CH2:4][O:5][c:6]1[c:7]([O:25][CH2:26][CH2:27][O:28][CH3:29])[cH:8][c:9]2[c:10]([NH:16][c:17]3[cH:18][c:19]([C:23]#[CH:24])[cH:20][cH:21][cH:22]3)[n:11][cH:12][n:13][c:14]2[cH:15]1)[O:33][C:30]([CH3:31])=[O:32]

Participants

7

Sources & evidence

ORD record
ord-ebc6c1843f1f49c19ac2819865ad0888
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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