bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane

C109H133Br2F9I2N16O9S3Sn — CID 157483838

About bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane

bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane (PubChem CID 157483838) has the molecular formula C109H133Br2F9I2N16O9S3Sn and a molecular weight of 2610.88 g/mol. Its IUPAC name is bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane.

Molecular Properties

• Compound Name: bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane
• PubChem CID: 157483838
• Molecular Formula: C109H133Br2F9I2N16O9S3Sn
• Molecular Weight: 2610.88 g/mol
• Exact Mass: 2608.49
• IUPAC Name: bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane
• SMILES: BrC1CCC1.C1CCOC1.CCCC[Sn](CCCC)(CCCC)c1cn(C2CCC2)cn1.CNS(=O)(=O)c1ccc(Cc2ccc(C(F)(F)F)cn2)c(-c2cn(C3CCC3)cn2)c1.COc1ccc(CN(C)S(=O)(=O)c2ccc(Cc3ccc(C(F)(F)F)cn3)c(-c3cn(C4CCC4)cn3)c2)cc1.COc1ccc(CN(C)S(=O)(=O)c2ccc(Cc3ccc(C(F)(F)F)cn3)c(Br)c2)cc1.Ic1cn(C2CCC2)cn1.Ic1cnc[nH]1
• InChI: InChI=1S/C29H29F3N4O3S.C22H20BrF3N2O3S.C21H21F3N4O2S.C7H9IN2.C7H9N2.C4H7Br.C4H8O.3C4H9.C3H3IN2.Sn/c1-35(17-20-6-11-25(39-2)12-7-20)40(37,38)26-13-8-21(14-23-10-9-22(16-33-23)29(30,31)32)27(15-26)28-18-36(19-34-28)24-4-3-5-24;1-28(14-15-3-8-19(31-2)9-4-15)32(29,30)20-10-5-16(21(23)12-20)11-18-7-6-17(13-27-18)22(24,25)26;1-25-31(29,30)18-8-5-14(9-16-7-6-15(11-26-16)21(22,23)24)19(10-18)20-12-28(13-27-20)17-3-2-4-17;8-7-4-10(5-9-7)6-2-1-3-6;1-2-7(3-1)9-5-4-8-6-9;5-4-2-1-3-4;1-2-4-5-3-1;3*1-3-4-2;4-3-1-5-2-6-3;/h6-13,15-16,18-19,24H,3-5,14,17H2,1-2H3;3-10,12-13H,11,14H2,1-2H3;5-8,10-13,17,25H,2-4,9H2,1H3;4-6H,1-3H2;5-7H,1-3H2;4H,1-3H2;1-4H2;3*1,3-4H2,2H3;1-2H,(H,5,6)
• InChIKey: BWLYXXXCULNCAA-UHFFFAOYSA-N
• XLogP: 27.20
• TPSA: 287.25 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 21
• Rotatable Bonds: 34
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2610.88
LogP ≤ 5	27.20
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane?

The IUPAC name of bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane (CID 157483838) is bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane.

What is the SMILES notation for bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane?

The canonical SMILES for bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane is BrC1CCC1.C1CCOC1.CCCC[Sn](CCCC)(CCCC)c1cn(C2CCC2)cn1.CNS(=O)(=O)c1ccc(Cc2ccc(C(F)(F)F)cn2)c(-c2cn(C3CCC3)cn2)c1.COc1ccc(CN(C)S(=O)(=O)c2ccc(Cc3ccc(C(F)(F)F)cn3)c(-c3cn(C4CCC4)cn3)c2)cc1.COc1ccc(CN(C)S(=O)(=O)c2ccc(Cc3ccc(C(F)(F)F)cn3)c(Br)c2)cc1.Ic1cn(C2CCC2)cn1.Ic1cnc[nH]1.

What is the InChIKey of bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane?

The InChIKey is BWLYXXXCULNCAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H29F3N4O3S.C22H20BrF3N2O3S.C21H21F3N4O2S.C7H9IN2.C7H9N2.C4H7Br.C4H8O.3C4H9.C3H3IN2.Sn/c1-35(17-20-6-11-25(39-2)12-7-20)40(37,38)26-13-8-21(14-23-10-9-22(16-33-23)29(30,31)32)27(15-26)28-18-36(19-34-28)24-4-3-5-24;1-28(14-15-3-8-19(31-2)9-4-15)32(29,30)20-10-5-16(21(23)12-20)11-18-7-6-17(13-27-18)22(24,25)26;1-25-31(29,30)18-8-5-14(9-16-7-6-15(11-26-16)21(22,23)24)19(10-18)20-12-28(13-27-20)17-3-2-4-17;8-7-4-10(5-9-7)6-2-1-3-6;1-2-7(3-1)9-5-4-8-6-9;5-4-2-1-3-4;1-2-4-5-3-1;3*1-3-4-2;4-3-1-5-2-6-3;/h6-13,15-16,18-19,24H,3-5,14,17H2,1-2H3;3-10,12-13H,11,14H2,1-2H3;5-8,10-13,17,25H,2-4,9H2,1H3;4-6H,1-3H2;5-7H,1-3H2;4H,1-3H2;1-4H2;3*1,3-4H2,2H3;1-2H,(H,5,6);.

What are the key properties of bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane?

bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane has a molecular weight of 2610.88 g/mol, XLogP of 27.20, 34 rotatable bonds, 2 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for bromocyclobutane;3-bromo-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-[(4-methoxyphenyl)methyl]-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;3-(1-cyclobutylimidazol-4-yl)-N-methyl-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]benzenesulfonamide;1-cyclobutyl-4-iodoimidazole;5-iodo-1H-imidazole;oxolane;tributyl-(1-cyclobutylimidazol-4-yl)stannane is sourced from PubChem (CID 157483838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).