4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide

C93H135Br2Cl2F6N13O15S5Si3 — CID 158180507

About 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide

4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide (PubChem CID 158180507) has the molecular formula C93H135Br2Cl2F6N13O15S5Si3 and a molecular weight of 2264.47 g/mol. Its IUPAC name is 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide.

Molecular Properties

• Compound Name: 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide
• PubChem CID: 158180507
• Molecular Formula: C93H135Br2Cl2F6N13O15S5Si3
• Molecular Weight: 2264.47 g/mol
• Exact Mass: 2259.58
• IUPAC Name: 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide
• SMILES: CC(C)(C)N.CC(C)(C)NS(=O)(=O)c1ccc(Br)cc1.CC(C)(C)NS(=O)(=O)c1ccc([Si](C)(C)C)cc1.CC(C)(COc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1)C(F)(F)F.C[C@@H]1CN(c2nc(-n3ccc(OCC(C)(C)C(F)(F)F)n3)ccc2C(=O)NS(=O)(=O)c2ccc([Si](C)(C)C)cc2)C(C)(C)C1.C[C@@H]1CNC(C)(C)C1.C[Si](C)(C)c1ccc(S(N)(=O)=O)cc1.O=S(=O)(Cl)c1ccc(Br)cc1
• InChI: InChI=1S/C30H40F3N5O4SSi.C14H13ClF3N3O3.C13H23NO2SSi.C10H14BrNO2S.C9H15NO2SSi.C7H15N.C6H4BrClO2S.C4H11N/c1-20-17-29(4,5)37(18-20)26-23(27(39)36-43(40,41)21-9-11-22(12-10-21)44(6,7)8)13-14-24(34-26)38-16-15-25(35-38)42-19-28(2,3)30(31,32)33;1-13(2,14(16,17)18)7-24-10-5-6-21(20-10)9-4-3-8(12(22)23)11(15)19-9;1-13(2,3)14-17(15,16)11-7-9-12(10-8-11)18(4,5)6;1-10(2,3)12-15(13,14)9-6-4-8(11)5-7-9;1-14(2,3)9-6-4-8(5-7-9)13(10,11)12;1-6-4-7(2,3)8-5-6;7-5-1-3-6(4-2-5)11(8,9)10;1-4(2,3)5/h9-16,20H,17-19H2,1-8H3,(H,36,39);3-6H,7H2,1-2H3,(H,22,23);7-10,14H,1-6H3;4-7,12H,1-3H3;4-7H,1-3H3,(H2,10,11,12);6,8H,4-5H2,1-3H3;1-4H;5H2,1-3H3/t20-;;;;;6-;;/m0....0../s1
• InChIKey: FYNIRDHGBZWTRE-PXHOJMFGSA-N
• XLogP: 19.34
• TPSA: 408.35 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 23
• Rotatable Bonds: 22
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2264.47
LogP ≤ 5	19.34
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide?

The IUPAC name of 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide (CID 158180507) is 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide.

What is the SMILES notation for 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide?

The canonical SMILES for 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide is CC(C)(C)N.CC(C)(C)NS(=O)(=O)c1ccc(Br)cc1.CC(C)(C)NS(=O)(=O)c1ccc([Si](C)(C)C)cc1.CC(C)(COc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1)C(F)(F)F.C[C@@H]1CN(c2nc(-n3ccc(OCC(C)(C)C(F)(F)F)n3)ccc2C(=O)NS(=O)(=O)c2ccc([Si](C)(C)C)cc2)C(C)(C)C1.C[C@@H]1CNC(C)(C)C1.C[Si](C)(C)c1ccc(S(N)(=O)=O)cc1.O=S(=O)(Cl)c1ccc(Br)cc1.

What is the InChIKey of 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide?

The InChIKey is FYNIRDHGBZWTRE-PXHOJMFGSA-N. The full InChI is InChI=1S/C30H40F3N5O4SSi.C14H13ClF3N3O3.C13H23NO2SSi.C10H14BrNO2S.C9H15NO2SSi.C7H15N.C6H4BrClO2S.C4H11N/c1-20-17-29(4,5)37(18-20)26-23(27(39)36-43(40,41)21-9-11-22(12-10-21)44(6,7)8)13-14-24(34-26)38-16-15-25(35-38)42-19-28(2,3)30(31,32)33;1-13(2,14(16,17)18)7-24-10-5-6-21(20-10)9-4-3-8(12(22)23)11(15)19-9;1-13(2,3)14-17(15,16)11-7-9-12(10-8-11)18(4,5)6;1-10(2,3)12-15(13,14)9-6-4-8(11)5-7-9;1-14(2,3)9-6-4-8(5-7-9)13(10,11)12;1-6-4-7(2,3)8-5-6;7-5-1-3-6(4-2-5)11(8,9)10;1-4(2,3)5/h9-16,20H,17-19H2,1-8H3,(H,36,39);3-6H,7H2,1-2H3,(H,22,23);7-10,14H,1-6H3;4-7,12H,1-3H3;4-7H,1-3H3,(H2,10,11,12);6,8H,4-5H2,1-3H3;1-4H;5H2,1-3H3/t20-;;;;;6-;;/m0....0../s1.

What are the key properties of 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide?

4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide has a molecular weight of 2264.47 g/mol, XLogP of 19.34, 22 rotatable bonds, 7 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 4-bromobenzenesulfonyl chloride;4-bromo-N-tert-butylbenzenesulfonamide;N-tert-butyl-4-trimethylsilylbenzenesulfonamide;2-chloro-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]pyridine-3-carboxylic acid;2-methylpropan-2-amine;6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]-N-(4-trimethylsilylphenyl)sulfonylpyridine-3-carboxamide;(4S)-2,2,4-trimethylpyrrolidine;4-trimethylsilylbenzenesulfonamide is sourced from PubChem (CID 158180507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).