2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))

C104H80F16N8Pt4S8 — CID 158572618

About 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))

2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+)) (PubChem CID 158572618) has the molecular formula C104H80F16N8Pt4S8 and a molecular weight of 2782.66 g/mol. Its IUPAC name is 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+)).

Molecular Properties

• Compound Name: 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))
• PubChem CID: 158572618
• Molecular Formula: C104H80F16N8Pt4S8
• Molecular Weight: 2782.66 g/mol
• Exact Mass: 2780.26
• IUPAC Name: 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))
• SMILES: CSc1ccnc(-c2[c-]c(C)cc(C(F)(F)F)c2)c1.CSc1ccnc(-c2[c-]c(C)cc(C(F)(F)F)c2)c1.CSc1ccnc(-c2[c-]cc(F)cc2)c1.CSc1ccnc(-c2[c-]cccc2F)c1.Cc1cc(-c2cc(CS)ccn2)[c-]c(C(F)(F)F)c1.Cc1cc(-c2cc(CS)ccn2)[c-]c(C(F)(F)F)c1.Fc1c[c-]c(-c2cc(CS)ccn2)cc1.Fc1ccc[c-]c1-c1cc(CS)ccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2]
• InChI: InChI=1S/4C14H11F3NS.4C12H9FNS.4Pt/c2*1-9-5-10(7-11(6-9)14(15,16)17)13-8-12(19-2)3-4-18-13;2*1-9-4-11(7-12(5-9)14(15,16)17)13-6-10(8-19)2-3-18-13;1-15-11-6-7-14-12(8-11)9-2-4-10(13)5-3-9;1-15-9-6-7-14-12(8-9)10-4-2-3-5-11(10)13;13-11-3-1-10(2-4-11)12-7-9(8-15)5-6-14-12;13-11-4-2-1-3-10(11)12-7-9(8-15)5-6-14-12;;;;/h2*3-4,6-8H,1-2H3;2*2-6,19H,8H2,1H3;2,4-8H,1H3;2-3,5-8H,1H3;1,3-7,15H,8H2;1-2,4-7,15H,8H2;;;;/q8*-1;4*+2
• InChIKey: VVIIJGUGTCJQTP-UHFFFAOYSA-N
• XLogP: 30.85
• TPSA: 103.12 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 16
• Rotatable Bonds: 16
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2782.66
LogP ≤ 5	30.85
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))?

The IUPAC name of 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+)) (CID 158572618) is 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+)).

What is the SMILES notation for 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))?

The canonical SMILES for 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+)) is CSc1ccnc(-c2[c-]c(C)cc(C(F)(F)F)c2)c1.CSc1ccnc(-c2[c-]c(C)cc(C(F)(F)F)c2)c1.CSc1ccnc(-c2[c-]cc(F)cc2)c1.CSc1ccnc(-c2[c-]cccc2F)c1.Cc1cc(-c2cc(CS)ccn2)[c-]c(C(F)(F)F)c1.Cc1cc(-c2cc(CS)ccn2)[c-]c(C(F)(F)F)c1.Fc1c[c-]c(-c2cc(CS)ccn2)cc1.Fc1ccc[c-]c1-c1cc(CS)ccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].

What is the InChIKey of 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))?

The InChIKey is VVIIJGUGTCJQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/4C14H11F3NS.4C12H9FNS.4Pt/c2*1-9-5-10(7-11(6-9)14(15,16)17)13-8-12(19-2)3-4-18-13;2*1-9-4-11(7-12(5-9)14(15,16)17)13-6-10(8-19)2-3-18-13;1-15-11-6-7-14-12(8-11)9-2-4-10(13)5-3-9;1-15-9-6-7-14-12(8-9)10-4-2-3-5-11(10)13;13-11-3-1-10(2-4-11)12-7-9(8-15)5-6-14-12;13-11-4-2-1-3-10(11)12-7-9(8-15)5-6-14-12;;;;/h2*3-4,6-8H,1-2H3;2*2-6,19H,8H2,1H3;2,4-8H,1H3;2-3,5-8H,1H3;1,3-7,15H,8H2;1-2,4-7,15H,8H2;;;;/q8*-1;4*+2.

What are the key properties of 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+))?

2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+)) has a molecular weight of 2782.66 g/mol, XLogP of 30.85, 16 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methylsulfanylpyridine;[2-(2-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;[2-(4-fluorobenzene-6-id-1-yl)-4-pyridinyl]methanethiol;bis(4-methylsulfanyl-2-[3-methyl-5-(trifluoromethyl)benzene-2-id-1-yl]pyridine);bis([2-[3-methyl-5-(trifluoromethyl)benzene-6-id-1-yl]-4-pyridinyl]methanethiol);tetrakis(platinum(2+)) is sourced from PubChem (CID 158572618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).