Benzene, 1-isocyanato-2-methoxy- → 3-[[3-Methoxy-2-[(2-methoxyphenyl)carbamoylamino]-3-oxopropyl]sulfanylmethyl]-4-oxo-4-pyridin-3-ylbutanoic acid

HRID 2126792Notes

Reaction equation

HRID 2126792 reaction equation
[CH3:40][O:41][c:42]1[c:43]([N:48]=[C:49]=[O:50])[cH:44][cH:45][cH:46][cH:47]1.[cH:1]1[c:2]2[c:12]([cH:13][cH:14][cH:15]1)-[c:7]1[c:6]([cH:11][cH:10][cH:9][cH:8]1)[CH:3]2[CH2:4][O:5][C:16](=[O:17])[NH:18][CH:19]([CH2:20][S:21][CH2:22][CH:23]([CH2:24][C:25](=[O:26])[OH:27])[C:28]([c:29]1[cH:30][n:31][cH:32][cH:33][cH:34]1)=[O:35])[C:36](=[O:37])[O:38][CH3:39]>>[C:16](=[O:17])([NH:18][CH:19]([CH2:20][S:21][CH2:22][CH:23]([CH2:24][C:25](=[O:26])[OH:27])[C:28]([c:29]1[cH:30][n:31][cH:32][cH:33][cH:34]1)=[O:35])[C:36](=[O:37])[O:38][CH3:39])[NH:48][c:43]1[c:42]([O:41][CH3:40])[cH:47][cH:46][cH:45][cH:44]1

Participants

3

Reactant 2

HCID 69695Benzene, 1-isocyanato-2-methoxy-HCID 178501004HCID 178501004, compound

Product 1

HCID 224577613-[[3-Methoxy-2-[(2-methoxyphenyl)carbamoylamino]-3-oxopropyl]sulfanylmethyl]-4-oxo-4-pyridin-3-ylbutanoic acid

Sources & evidence

ORD record
ord-da593cfeae8d4f8080565fcd0785f02d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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