(1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide

C124H160F4N20O32S8Si4 — CID 157054227

About (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide

(1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide (PubChem CID 157054227) has the molecular formula C124H160F4N20O32S8Si4 and a molecular weight of 2887.62 g/mol. Its IUPAC name is (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide.

Molecular Properties

• Compound Name: (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide
• PubChem CID: 157054227
• Molecular Formula: C124H160F4N20O32S8Si4
• Molecular Weight: 2887.62 g/mol
• Exact Mass: 2884.83
• IUPAC Name: (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide
• SMILES: COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1
• InChI: InChI=1S/4C31H40FN5O8S2Si/c4*1-20(29(38)22-16-15-21(32)19-26(22)46(5,39)40)47(41,42)36(17-18-48(6,7)8)31-35-34-30(23-11-9-14-27(33-23)45-4)37(31)28-24(43-2)12-10-13-25(28)44-3/h4*9-16,19-20,29,38H,17-18H2,1-8H3/t2*20-,29+;2*20-,29-/m1010/s1
• InChIKey: AAOGLPMURXTJGY-FRGVGOKKSA-N
• XLogP: 17.98
• TPSA: 652.16 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 48
• Rotatable Bonds: 56
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2887.62
LogP ≤ 5	17.98
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	48

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide?

The IUPAC name of (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide (CID 157054227) is (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide.

What is the SMILES notation for (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide?

The canonical SMILES for (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide is COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@H](O)c3ccc(F)cc3S(C)(=O)=O)n2-c2c(OC)cccc2OC)n1.

What is the InChIKey of (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide?

The InChIKey is AAOGLPMURXTJGY-FRGVGOKKSA-N. The full InChI is InChI=1S/4C31H40FN5O8S2Si/c4*1-20(29(38)22-16-15-21(32)19-26(22)46(5,39)40)47(41,42)36(17-18-48(6,7)8)31-35-34-30(23-11-9-14-27(33-23)45-4)37(31)28-24(43-2)12-10-13-25(28)44-3/h4*9-16,19-20,29,38H,17-18H2,1-8H3/t2*20-,29+;2*20-,29-/m1010/s1.

What are the key properties of (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide?

(1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide has a molecular weight of 2887.62 g/mol, XLogP of 17.98, 56 rotatable bonds, 4 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for (1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1R,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide;(1S,2R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-1-(4-fluoro-2-methylsulfonylphenyl)-1-hydroxy-N-(2-trimethylsilylethyl)propane-2-sulfonamide is sourced from PubChem (CID 157054227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).