2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide

C163H122N16Pt4S4-4 — CID 165081291

About 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide

2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide (PubChem CID 165081291) has the molecular formula C163H122N16Pt4S4-4 and a molecular weight of 3216.48 g/mol. Its IUPAC name is 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide.

Molecular Properties

• Compound Name: 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide
• PubChem CID: 165081291
• Molecular Formula: C163H122N16Pt4S4-4
• Molecular Weight: 3216.48 g/mol
• Exact Mass: 3213.77
• IUPAC Name: 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide
• SMILES: CC(C)c1ccccc1-c1ccnc(-n2c3[c-]c(Sc4[c-]c(-n5[cH+]n(C(C)C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccccc1-c1ccnc(-n2c3[c-]c(Sc4[c-]c(-n5[cH+]n(C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.Cc1ccccc1-c1ccnc(-n2c3[c-]c(Sc4[c-]c(-n5[cH+]n(-c6ccccc6)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[2H]C([2H])([2H])n1[cH+]n(-c2[c-]c(Sc3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4C)ccn3)ccc2)c2ccccc21.[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C43H29N4S.C42H35N4S.C40H31N4S.C38H27N4S.4Pt/c1-30-12-5-6-17-36(30)31-24-25-44-43(26-31)47-39-19-8-7-18-37(39)38-23-22-35(28-42(38)47)48-34-16-11-15-33(27-34)46-29-45(32-13-3-2-4-14-32)40-20-9-10-21-41(40)46;1-28(2)34-14-5-6-15-35(34)30-22-23-43-42(24-30)46-38-17-8-7-16-36(38)37-21-20-33(26-41(37)46)47-32-13-11-12-31(25-32)45-27-44(29(3)4)39-18-9-10-19-40(39)45;1-27(2)32-13-4-5-14-33(32)28-21-22-41-40(23-28)44-36-16-7-6-15-34(36)35-20-19-31(25-39(35)44)45-30-12-10-11-29(24-30)43-26-42(3)37-17-8-9-18-38(37)43;1-26-10-3-4-13-31(26)27-20-21-39-38(22-27)42-34-15-6-5-14-32(34)33-19-18-30(24-37(33)42)43-29-12-9-11-28(23-29)41-25-40(2)35-16-7-8-17-36(35)41;;;;/h2-26,29H,1H3;5-24,27-29H,1-4H3;4-23,26-27H,1-3H3;3-22,25H,1-2H3;;;;/q4*-1;;;;/i;;;2D3
• InChIKey: CTQDSFBEUMKFIF-JEFAPWLYSA-N
• XLogP: 41.99
• TPSA: 110.72 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 25
• Heavy Atoms: 187
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3216.48
LogP ≤ 5	41.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide?

The IUPAC name of 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide (CID 165081291) is 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide.

What is the SMILES notation for 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide?

The canonical SMILES for 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide is CC(C)c1ccccc1-c1ccnc(-n2c3[c-]c(Sc4[c-]c(-n5[cH+]n(C(C)C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.CC(C)c1ccccc1-c1ccnc(-n2c3[c-]c(Sc4[c-]c(-n5[cH+]n(C)c6ccccc65)ccc4)ccc3c3ccccc32)c1.Cc1ccccc1-c1ccnc(-n2c3[c-]c(Sc4[c-]c(-n5[cH+]n(-c6ccccc6)c6ccccc65)ccc4)ccc3c3ccccc32)c1.[2H]C([2H])([2H])n1[cH+]n(-c2[c-]c(Sc3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4C)ccn3)ccc2)c2ccccc21.[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide?

The InChIKey is CTQDSFBEUMKFIF-JEFAPWLYSA-N. The full InChI is InChI=1S/C43H29N4S.C42H35N4S.C40H31N4S.C38H27N4S.4Pt/c1-30-12-5-6-17-36(30)31-24-25-44-43(26-31)47-39-19-8-7-18-37(39)38-23-22-35(28-42(38)47)48-34-16-11-15-33(27-34)46-29-45(32-13-3-2-4-14-32)40-20-9-10-21-41(40)46;1-28(2)34-14-5-6-15-35(34)30-22-23-43-42(24-30)46-38-17-8-7-16-36(38)37-21-20-33(26-41(37)46)47-32-13-11-12-31(25-32)45-27-44(29(3)4)39-18-9-10-19-40(39)45;1-27(2)32-13-4-5-14-33(32)28-21-22-41-40(23-28)44-36-16-7-6-15-34(36)35-20-19-31(25-39(35)44)45-30-12-10-11-29(24-30)43-26-42(3)37-17-8-9-18-38(37)43;1-26-10-3-4-13-31(26)27-20-21-39-38(22-27)42-34-15-6-5-14-32(34)33-19-18-30(24-37(33)42)43-29-12-9-11-28(23-29)41-25-40(2)35-16-7-8-17-36(35)41;;;;/h2-26,29H,1H3;5-24,27-29H,1-4H3;4-23,26-27H,1-3H3;3-22,25H,1-2H3;;;;/q4*-1;;;;/i;;;2D3;;;;.

What are the key properties of 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide?

2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide has a molecular weight of 3216.48 g/mol, XLogP of 41.99, 25 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-(3-methyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-(3-phenyl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;9-[4-(2-methylphenyl)-2-pyridinyl]-2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-2-ylium-1-yl]benzene-2-id-1-yl]sulfanyl-1H-carbazol-1-ide;platinum;2-[3-(3-propan-2-yl-2H-benzimidazol-2-ylium-1-yl)benzene-2-id-1-yl]sulfanyl-9-[4-(2-propan-2-ylphenyl)-2-pyridinyl]-1H-carbazol-1-ide is sourced from PubChem (CID 165081291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).