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

C112H172N20O24S4Si4 — CID 161384833

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

(2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide (PubChem CID 161384833) has the molecular formula C112H172N20O24S4Si4 and a molecular weight of 2423.34 g/mol. Its IUPAC name is (2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide.

Molecular Properties

• Compound Name: (2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide
• PubChem CID: 161384833
• Molecular Formula: C112H172N20O24S4Si4
• Molecular Weight: 2423.34 g/mol
• Exact Mass: 2421.08
• IUPAC Name: (2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide
• SMILES: COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)C(C)[C@H](O)C(C)(C)C)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)C(C)(C)C)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@@H](O)C(C)(C)C)n2-c2c(OC)cccc2OC)n1.COc1cccc(-c2nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@H](O)C(C)(C)C)n2-c2c(OC)cccc2OC)n1
• InChI: InChI=1S/4C28H43N5O6SSi/c4*1-19(25(34)28(2,3)4)40(35,36)32(17-18-41(8,9)10)27-31-30-26(20-13-11-16-23(29-20)39-7)33(27)24-21(37-5)14-12-15-22(24)38-6/h4*11-16,19,25,34H,17-18H2,1-10H3/t19?,25-;2*19-,25+;19-,25-/m0101/s1
• InChIKey: VSEVKLSHASOWGJ-KTHDJILOSA-N
• XLogP: 18.50
• TPSA: 515.60 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 40
• Rotatable Bonds: 48
• Heavy Atoms: 164
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2423.34
LogP ≤ 5	18.50
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

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

Frequently Asked Questions

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

The IUPAC name of (2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide (CID 161384833) is (2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide.

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

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

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

The InChIKey is VSEVKLSHASOWGJ-KTHDJILOSA-N. The full InChI is InChI=1S/4C28H43N5O6SSi/c4*1-19(25(34)28(2,3)4)40(35,36)32(17-18-41(8,9)10)27-31-30-26(20-13-11-16-23(29-20)39-7)33(27)24-21(37-5)14-12-15-22(24)38-6/h4*11-16,19,25,34H,17-18H2,1-10H3/t19?,25-;2*19-,25+;19-,25-/m0101/s1.

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

(2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide has a molecular weight of 2423.34 g/mol, XLogP of 18.50, 48 rotatable bonds, 4 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2R,3R)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide;(2S,3S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-1,2,4-triazol-3-yl]-3-hydroxy-4,4-dimethyl-N-(2-trimethylsilylethyl)pentane-2-sulfonamide is sourced from PubChem (CID 161384833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).