About (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide
(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide (PubChem CID 158175098) has the molecular formula C347H353Cl9FN37O58S3
and a molecular weight of 6404.12 g/mol. Its IUPAC name is (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide.
Frequently Asked Questions
What is the IUPAC name of (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide?
The IUPAC name of (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide (CID 158175098) is (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide.
What is the SMILES notation for (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide?
The canonical SMILES for (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide is COc1cccc(-c2ccc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N3CCC[C@@H]3c3cccc(Cl)c3)cc2)n1.COc1ncccc1-c1ccc([C@@H](C)NC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccc(Cl)c2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1)c1ccc(-c2ccc[nH]c2=O)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1)c1ccc(-c2cccc(=O)[nH]2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1cccc(Cl)c1)c1ccc(-c2ccncc2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1cccc(Cl)c1)c1ccc(-c2ccncc2Cl)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1ccccc1)c1ccc(-c2cccs2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1ccccc1)c1ccc(-c2ccsc2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1ccccc1)c1ccc(-c2ccsc2C#N)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1Cc2ccccc2C1)c1ccc(-c2cccc(=O)[nH]2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1Cc2ccccc2C1)c1ccc(-c2ccnc3ccc(F)cc23)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1Cc2ccccc2C1)c1ccc(-c2ccncc2Cl)cc1.O=C(NCc1ccc(-c2ccc[nH]c2=O)cc1)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1.
What is the InChIKey of (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide?
The InChIKey is FXXGXGXFJSYFAH-XGLMHHDLSA-N. The full InChI is InChI=1S/C29H26FN3O4.C28H30ClN3O5.C27H27Cl2N3O4.3C27H28ClN3O5.C27H28ClN3O4.C27H27N3O4S.C26H26ClN3O5.2C26H28N2O4S.C25H24ClN3O4.C25H25N3O5/c1-17(18-6-8-19(9-7-18)23-12-13-31-25-11-10-22(30)14-24(23)25)32-28(36)26(34)27(35)29(37)33-15-20-4-2-3-5-21(20)16-33;1-17(18-10-12-19(13-11-18)22-8-4-14-30-27(22)37-2)31-26(35)24(33)25(34)28(36)32-15-5-9-23(32)20-6-3-7-21(29)16-20;1-16(17-7-9-18(10-8-17)21-11-12-30-15-22(21)29)31-26(35)24(33)25(34)27(36)32-13-3-6-23(32)19-4-2-5-20(28)14-19;1-16(17-9-11-18(12-10-17)21-7-3-13-29-25(21)34)30-26(35)23(32)24(33)27(36)31-14-4-8-22(31)19-5-2-6-20(28)15-19;1-36-23-9-3-7-21(30-23)18-12-10-17(11-13-18)16-29-26(34)24(32)25(33)27(35)31-14-4-8-22(31)19-5-2-6-20(28)15-19;1-16(17-10-12-18(13-11-17)21-7-3-9-23(32)30-21)29-26(35)24(33)25(34)27(36)31-14-4-8-22(31)19-5-2-6-20(28)15-19;1-17(18-7-9-19(10-8-18)20-11-13-29-14-12-20)30-26(34)24(32)25(33)27(35)31-15-3-6-23(31)21-4-2-5-22(28)16-21;1-17(18-9-11-19(12-10-18)21-13-15-35-23(21)16-28)29-26(33)24(31)25(32)27(34)30-14-5-8-22(30)20-6-3-2-4-7-20;27-19-5-1-4-18(14-19)21-7-3-13-30(21)26(35)23(32)22(31)25(34)29-15-16-8-10-17(11-9-16)20-6-2-12-28-24(20)33;1-17(18-11-13-20(14-12-18)22-10-6-16-33-22)27-25(31)23(29)24(30)26(32)28-15-5-9-21(28)19-7-3-2-4-8-19;1-17(18-9-11-19(12-10-18)21-13-15-33-16-21)27-25(31)23(29)24(30)26(32)28-14-5-8-22(28)20-6-3-2-4-7-20;1-15(16-6-8-17(9-7-16)20-10-11-27-12-21(20)26)28-24(32)22(30)23(31)25(33)29-13-18-4-2-3-5-19(18)14-29;1-15(16-9-11-17(12-10-16)20-7-4-8-21(29)27-20)26-24(32)22(30)23(31)25(33)28-13-18-5-2-3-6-19(18)14-28/h2-14,17,26-27,34-35H,15-16H2,1H3,(H,32,36);3-4,6-8,10-14,16-17,23-25,33-34H,5,9,15H2,1-2H3,(H,31,35);2,4-5,7-12,14-16,23-25,33-34H,3,6,13H2,1H3,(H,31,35);2-3,5-7,9-13,15-16,22-24,32-33H,4,8,14H2,1H3,(H,29,34)(H,30,35);2-3,5-7,9-13,15,22,24-25,32-33H,4,8,14,16H2,1H3,(H,29,34);2-3,5-7,9-13,15-16,22,24-25,33-34H,4,8,14H2,1H3,(H,29,35)(H,30,32);2,4-5,7-14,16-17,23-25,32-33H,3,6,15H2,1H3,(H,30,34);2-4,6-7,9-13,15,17,22,24-25,31-32H,5,8,14H2,1H3,(H,29,33);1-2,4-6,8-12,14,21-23,31-32H,3,7,13,15H2,(H,28,33)(H,29,34);2-4,6-8,10-14,16-17,21,23-24,29-30H,5,9,15H2,1H3,(H,27,31);2-4,6-7,9-13,15-17,22-24,29-30H,5,8,14H2,1H3,(H,27,31);2-12,15,22-23,30-31H,13-14H2,1H3,(H,28,32);2-12,15,22-23,30-31H,13-14H2,1H3,(H,26,32)(H,27,29)/t17-,26-,27-;17-,23?,24-,25-;16-,23-,24-,25-;16-,22?,23-,24-;22-,24-,25-;16-,22?,24-,25-;17-,23-,24-,25-;17-,22-,24-,25-;21?,22-,23-;17-,21-,23-,24-;17-,22-,23-,24-;2*15-,22-,23-/m1111111111111/s1.
What are the key properties of (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide?
(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide has a molecular weight of 6404.12 g/mol, XLogP of 41.80, 90 rotatable bonds, 43 hydrogen bond donors, and 68 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)phenyl]ethyl]-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-(6-methoxy-2-pyridinyl)phenyl]methyl]-4-oxobutanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[[4-(2-oxo-1H-pyridin-3-yl)phenyl]methyl]butanamide;(2R,3R)-4-[(2R)-2-(3-chlorophenyl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyridin-4-ylphenyl)ethyl]butanamide;(2R,3R)-N-[(1R)-1-[4-(3-chloro-4-pyridinyl)phenyl]ethyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[(1R)-1-[4-(2-cyanothiophen-3-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxo-N-[(1R)-1-[4-(6-oxo-1H-pyridin-2-yl)phenyl]ethyl]butanamide;(2R,3R)-4-(1,3-dihydroisoindol-2-yl)-N-[(1R)-1-[4-(6-fluoroquinolin-4-yl)phenyl]ethyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-2-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]-N-[(1R)-1-(4-thiophen-3-ylphenyl)ethyl]butanamide is sourced from PubChem (CID 158175098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).