9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum

C176H132N25O5Pt5-15 — CID 157288645

About 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum

9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum (PubChem CID 157288645) has the molecular formula C176H132N25O5Pt5-15 and a molecular weight of 3652.55 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum
• PubChem CID: 157288645
• Molecular Formula: C176H132N25O5Pt5-15
• Molecular Weight: 3652.55 g/mol
• Exact Mass: 3649.92
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum
• SMILES: CN1[CH-]N(c2[c-]c(Oc3[c-]c4c(c(C#N)c3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.CN1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3c(C#N)cccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.CN1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccc(C#N)cc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.[C-]#[N+]c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)[c-]c(N2[CH-]N(C)c3ccccc32)c1.[C-]#[N+]c1cccc2c3ccc(Oc4[c-]c(N5[CH-]N(C)c6ccccc65)ccc4)[c-]c3n(-c3cc(C(C)(C)C)ccn3)c12.[Pt].[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/4C36H28N5O.C32H20N5O.5Pt/c1-36(2,3)24-18-19-38-34(20-24)41-33-22-27(16-17-28(33)29-12-9-13-30(37-4)35(29)41)42-26-11-8-10-25(21-26)40-23-39(5)31-14-6-7-15-32(31)40;1-36(2,3)25-17-18-38-34(19-25)41-32-14-7-9-24(22-37)35(32)29-16-15-28(21-33(29)41)42-27-11-8-10-26(20-27)40-23-39(4)30-12-5-6-13-31(30)40;1-36(2,3)25-16-17-38-34(19-25)41-30-13-6-5-12-29(30)35-24(22-37)18-28(21-33(35)41)42-27-11-9-10-26(20-27)40-23-39(4)31-14-7-8-15-32(31)40;1-36(2,3)25-16-17-38-35(19-25)41-33-18-24(22-37)12-14-29(33)30-15-13-28(21-34(30)41)42-27-9-7-8-26(20-27)40-23-39(4)31-10-5-6-11-32(31)40;1-33-22-17-23(36-21-35(2)29-11-5-6-12-30(29)36)19-25(18-22)38-24-14-15-27-26-9-3-4-10-28(26)37(31(27)20-24)32-13-7-8-16-34-32;;;;;/h6-20,23H,1-3,5H3;3*5-19,23H,1-4H3;3-18,21H,2H3;;;;;/q5*-3
• InChIKey: QSEZVMWLVSKOEN-UHFFFAOYSA-N
• XLogP: 42.29
• TPSA: 247.74 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 20
• Heavy Atoms: 211
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3652.55
LogP ≤ 5	42.29
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum (CID 157288645) is 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum?

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum is CN1[CH-]N(c2[c-]c(Oc3[c-]c4c(c(C#N)c3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.CN1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3c(C#N)cccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.CN1[CH-]N(c2[c-]c(Oc3[c-]c4c(cc3)c3ccc(C#N)cc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.[C-]#[N+]c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)[c-]c(N2[CH-]N(C)c3ccccc32)c1.[C-]#[N+]c1cccc2c3ccc(Oc4[c-]c(N5[CH-]N(C)c6ccccc65)ccc4)[c-]c3n(-c3cc(C(C)(C)C)ccn3)c12.[Pt].[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum?

The InChIKey is QSEZVMWLVSKOEN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C36H28N5O.C32H20N5O.5Pt/c1-36(2,3)24-18-19-38-34(20-24)41-33-22-27(16-17-28(33)29-12-9-13-30(37-4)35(29)41)42-26-11-8-10-25(21-26)40-23-39(5)31-14-6-7-15-32(31)40;1-36(2,3)25-17-18-38-34(19-25)41-32-14-7-9-24(22-37)35(32)29-16-15-28(21-33(29)41)42-27-11-8-10-26(20-27)40-23-39(4)30-12-5-6-13-31(30)40;1-36(2,3)25-16-17-38-34(19-25)41-30-13-6-5-12-29(30)35-24(22-37)18-28(21-33(35)41)42-27-11-9-10-26(20-27)40-23-39(4)31-14-7-8-15-32(31)40;1-36(2,3)25-16-17-38-35(19-25)41-33-18-24(22-37)12-14-29(33)30-15-13-28(21-34(30)41)42-27-9-7-8-26(20-27)40-23-39(4)31-10-5-6-11-32(31)40;1-33-22-17-23(36-21-35(2)29-11-5-6-12-30(29)36)19-25(18-22)38-24-14-15-27-26-9-3-4-10-28(26)37(31(27)20-24)32-13-7-8-16-34-32;;;;;/h6-20,23H,1-3,5H3;3*5-19,23H,1-4H3;3-18,21H,2H3;;;;;/q5*-3;;;;;.

What are the key properties of 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum?

9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum has a molecular weight of 3652.55 g/mol, XLogP of 42.29, 20 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-8-isocyano-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide-4-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-2-carbonitrile;9-(4-tert-butyl-2-pyridinyl)-7-[3-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-8H-carbazol-8-ide-4-carbonitrile;2-[3-isocyano-5-(3-methyl-2H-benzimidazol-2-id-1-yl)benzene-6-id-1-yl]oxy-9-pyridin-2-yl-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 157288645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).