2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine

C143H150ClF14N7O17S12 — CID 163716191

About 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine

2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine (PubChem CID 163716191) has the molecular formula C143H150ClF14N7O17S12 and a molecular weight of 2925.03 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine.

Molecular Properties

• Compound Name: 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine
• PubChem CID: 163716191
• Molecular Formula: C143H150ClF14N7O17S12
• Molecular Weight: 2925.03 g/mol
• Exact Mass: 2921.72
• IUPAC Name: 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine
• SMILES: C=S(C)(=O)c1ccc(C)c(C(F)(F)F)c1.C=S(C)(=O)c1ccc(C)c(F)c1.C=S(C)(=O)c1ccc(C)cc1.C=S(C)(=O)c1ccc(C)nc1.C=S1(=O)CCC(F)(F)c2cc(C)ccc21.C=S1(=O)CCc2c(C)cccc21.C=S1(=O)CCc2ccccc21.Cc1ccc(C(F)(F)F)nc1.Cc1ccc(F)cc1C(F)(F)F.Cc1ccc(S(C)(=O)=O)nc1.Cc1ccc2c(c1)S(=O)(=O)CC2.Cc1ccc2ccccc2n1.Cc1cccnc1S(=O)(=O)c1ccc(Cl)cc1.Cc1cccnc1S(=O)(=O)c1ccc(F)cc1.Cc1cccnc1S(=O)(=O)c1ccccc1
• InChI: InChI=1S/C12H10ClNO2S.C12H10FNO2S.C12H11NO2S.C11H12F2OS.C10H11F3OS.C10H9N.C10H12OS.C9H11FOS.C9H10O2S.C9H10OS.C9H12OS.C8H6F4.C8H11NOS.C7H6F3N.C7H9NO2S/c2*1-9-3-2-8-14-12(9)17(15,16)11-6-4-10(13)5-7-11;1-10-6-5-9-13-12(10)16(14,15)11-7-3-2-4-8-11;1-8-3-4-10-9(7-8)11(12,13)5-6-15(10,2)14;1-7-4-5-8(15(2,3)14)6-9(7)10(11,12)13;1-8-6-7-9-4-2-3-5-10(9)11-8;1-8-4-3-5-10-9(8)6-7-12(10,2)11;1-7-4-5-8(6-9(7)10)12(2,3)11;1-7-2-3-8-4-5-12(10,11)9(8)6-7;1-11(10)7-6-8-4-2-3-5-9(8)11;1-8-4-6-9(7-5-8)11(2,3)10;1-5-2-3-6(9)4-7(5)8(10,11)12;1-7-4-5-8(6-9-7)11(2,3)10;1-5-2-3-6(11-4-5)7(8,9)10;1-6-3-4-7(8-5-6)11(2,9)10/h2*2-8H,1H3;2-9H,1H3;3-4,7H,2,5-6H2,1H3;4-6H,2H2,1,3H3;2-7H,1H3;3-5H,2,6-7H2,1H3;4-6H,2H2,1,3H3;2-3,6H,4-5H2,1H3;2-5H,1,6-7H2;4-7H,2H2,1,3H3;2-4H,1H3;4-6H,2H2,1,3H3;2-4H,1H3;3-5H,1-2H3
• InChIKey: KNNYLPGMUWMXRM-UHFFFAOYSA-N
• XLogP: 30.55
• TPSA: 380.42 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 11
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2925.03
LogP ≤ 5	30.55
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine?

The IUPAC name of 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine (CID 163716191) is 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine.

What is the SMILES notation for 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine?

The canonical SMILES for 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine is C=S(C)(=O)c1ccc(C)c(C(F)(F)F)c1.C=S(C)(=O)c1ccc(C)c(F)c1.C=S(C)(=O)c1ccc(C)cc1.C=S(C)(=O)c1ccc(C)nc1.C=S1(=O)CCC(F)(F)c2cc(C)ccc21.C=S1(=O)CCc2c(C)cccc21.C=S1(=O)CCc2ccccc21.Cc1ccc(C(F)(F)F)nc1.Cc1ccc(F)cc1C(F)(F)F.Cc1ccc(S(C)(=O)=O)nc1.Cc1ccc2c(c1)S(=O)(=O)CC2.Cc1ccc2ccccc2n1.Cc1cccnc1S(=O)(=O)c1ccc(Cl)cc1.Cc1cccnc1S(=O)(=O)c1ccc(F)cc1.Cc1cccnc1S(=O)(=O)c1ccccc1.

What is the InChIKey of 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine?

The InChIKey is KNNYLPGMUWMXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO2S.C12H10FNO2S.C12H11NO2S.C11H12F2OS.C10H11F3OS.C10H9N.C10H12OS.C9H11FOS.C9H10O2S.C9H10OS.C9H12OS.C8H6F4.C8H11NOS.C7H6F3N.C7H9NO2S/c2*1-9-3-2-8-14-12(9)17(15,16)11-6-4-10(13)5-7-11;1-10-6-5-9-13-12(10)16(14,15)11-7-3-2-4-8-11;1-8-3-4-10-9(7-8)11(12,13)5-6-15(10,2)14;1-7-4-5-8(15(2,3)14)6-9(7)10(11,12)13;1-8-6-7-9-4-2-3-5-10(9)11-8;1-8-4-3-5-10-9(8)6-7-12(10,2)11;1-7-4-5-8(6-9(7)10)12(2,3)11;1-7-2-3-8-4-5-12(10,11)9(8)6-7;1-11(10)7-6-8-4-2-3-5-9(8)11;1-8-4-6-9(7-5-8)11(2,3)10;1-5-2-3-6(9)4-7(5)8(10,11)12;1-7-4-5-8(6-9-7)11(2,3)10;1-5-2-3-6(11-4-5)7(8,9)10;1-6-3-4-7(8-5-6)11(2,9)10/h2*2-8H,1H3;2-9H,1H3;3-4,7H,2,5-6H2,1H3;4-6H,2H2,1,3H3;2-7H,1H3;3-5H,2,6-7H2,1H3;4-6H,2H2,1,3H3;2-3,6H,4-5H2,1H3;2-5H,1,6-7H2;4-7H,2H2,1,3H3;2-4H,1H3;4-6H,2H2,1,3H3;2-4H,1H3;3-5H,1-2H3.

What are the key properties of 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine?

2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine has a molecular weight of 2925.03 g/mol, XLogP of 30.55, 11 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(benzenesulfonyl)-3-methylpyridine;2-(4-chlorophenyl)sulfonyl-3-methylpyridine;4,4-difluoro-6-methyl-1-methylidene-2,3-dihydrothiochromene 1-oxide;(3-fluoro-4-methylphenyl)-methyl-methylidene-oxo-λ6-sulfane;4-fluoro-1-methyl-2-(trifluoromethyl)benzene;2-(4-fluorophenyl)sulfonyl-3-methylpyridine;6-methyl-2,3-dihydro-1-benzothiophene 1,1-dioxide;1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;4-methyl-1-methylidene-2,3-dihydro-1-benzothiophene 1-oxide;methyl-methylidene-(4-methylphenyl)-oxo-λ6-sulfane;methyl-methylidene-(6-methyl-3-pyridinyl)-oxo-λ6-sulfane;methyl-methylidene-[4-methyl-3-(trifluoromethyl)phenyl]-oxo-λ6-sulfane;5-methyl-2-methylsulfonylpyridine;2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 163716191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).