2-(Methoxycarbonylamino)-3,3-diphenylpropanoic acid → methyl N-[1-[[5-[(4-amino-3-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]amino]-1-oxo-3,3-diphenylpropan-2-yl]carbamate

HRID 688110Notes

Reaction equation

HRID 688110 reaction equation
[CH3:25][O:26][C:27](=[O:28])[NH:29][CH:30]([C:31](=[O:32])[OH:33])[CH:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[NH2:1][c:2]1[c:3]([Cl:24])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][CH:13]([CH3:14])[CH3:15])[CH:16]([CH2:17][CH2:18][CH2:19][CH2:20][NH2:21])[CH2:22][OH:23])[cH:6][cH:7]1>>[NH2:1][c:2]1[c:3]([Cl:24])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][CH:13]([CH3:14])[CH3:15])[CH:16]([CH2:17][CH2:18][CH2:19][CH2:20][NH:21][C:31]([CH:30]([NH:29][C:27]([O:26][CH3:25])=[O:28])[CH:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)=[O:32])[CH2:22][OH:23])[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 180089872-(Methoxycarbonylamino)-3,3-diphenylpropanoic acidHCID 180090084-amino-N-(6-amino-1-hydroxyhexan-2-yl)-3-chloro-N-(2-methylpropyl)benzenesulfonamide

Product 1

HCID 67532697methyl N-[1-[[5-[(4-amino-3-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-6-hydroxyhexyl]amino]-1-oxo-3,3-diphenylpropan-2-yl]carbamate

Sources & evidence

ORD record
ord-dee6aa322e2b4d998e5ebf7e1fefeecb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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