Dichloromethane → methyl N-[1-[[5-[(4-cyanophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]amino]-1-oxo-3,3-diphenylpropan-2-yl]carbamate

HRID 290882Notes

Reaction equation

HRID 290882 reaction equation
[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:32][O:33][C:34](=[O:35])[NH:36][CH:37]([C:38](=[O:39])[OH:40])[CH:41]([c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[Cl:54][CH2:55][Cl:56].[NH2:1][CH2:2][CH2:3][CH2:4][CH2:5][CH:6]([CH2:7][OH:8])[N:9]([S:10](=[O:11])(=[O:12])[c:13]1[cH:14][cH:15][c:16]([C:19]#[N:20])[cH:17][cH:18]1)[CH2:21][CH:22]([CH3:23])[CH3:24]>>[NH:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH:6]([CH2:7][OH:8])[N:9]([S:10](=[O:11])(=[O:12])[c:13]1[cH:14][cH:15][c:16]([C:19]#[N:20])[cH:17][cH:18]1)[CH2:21][CH:22]([CH3:23])[CH3:24])[C:38]([CH:37]([NH:36][C:34]([O:33][CH3:32])=[O:35])[CH:41]([c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)=[O:39]

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 180089872-(Methoxycarbonylamino)-3,3-diphenylpropanoic acidHCID 18009004N-(6-amino-1-hydroxyhexan-2-yl)-4-cyano-N-(2-methylpropyl)benzenesulfonamide

Product 1

HCID 68913324methyl N-[1-[[5-[(4-cyanophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]amino]-1-oxo-3,3-diphenylpropan-2-yl]carbamate

Sources & evidence

ORD record
ord-c87df46d06324319b6f5e83b9bd933e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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