Benzoyl chloride → HCID 10101690, compound

HRID 1210904Notes

Reaction equation

[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][S:18](=[O:19])(=[O:20])[c:21]1[c:22](-[c:27]2[cH:28][c:29]([F:59])[c:30]([CH2:33][n:34]3[c:35](=[O:58])[n:36](-[c:43]4[c:44]([C:54]([F:55])([F:56])[F:57])[cH:45][cH:46][c:47]([NH:49][C:50](=[O:51])[CH2:52][CH3:53])[cH:48]4)[n:37][c:38]3[CH2:39][CH2:40][CH2:41][CH3:42])[cH:31][cH:32]2)[cH:23][cH:24][cH:25][cH:26]1.[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[Cl:9]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[NH:49][c:47]1[cH:46][cH:45][c:44]([C:54]([F:55])([F:56])[F:57])[c:43](-[n:36]2[c:35](=[O:58])[n:34]([CH2:33][c:30]3[c:29]([F:59])[cH:28][c:27](-[c:22]4[c:21]([S:18]([NH:17][C:15]([O:14][C:10]([CH3:11])([CH3:12])[CH3:13])=[O:16])(=[O:19])=[O:20])[cH:26][cH:25][cH:24][cH:23]4)[cH:32][cH:31]3)[c:38]([CH2:39][CH2:40][CH2:41][CH3:42])[n:37]2)[cH:48]1

Participants

Reactant 2

HCID 7412Benzoyl chloride

HCID 9987414HCID 9987414, compound

Product 1

HCID 10101690HCID 10101690, compound

Sources & evidence

ORD record: ord-fba1db8bd3384b588f6901e4e0f875e6
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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