2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))

C85H70N28O5Pt4S4 — CID 161109962

IUPAC2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))
SMILESCC(C)(c1cccc(-n2[c-]ncc2)n1)c1cccc(-n2[c-]ncc2)n1.COc1n[c-]n(-c2cccc(C(C)(C)c3cccc(-n4[c-]nc(OC)c4OC)n3)n2)c1OC.CSc1n[c-]n(-c2cccc(C(C)(C)c3cccc(-n4[c-]nc(SC)c4SC)n3)n2)c1SC.[C-]#[N+]c1n[c-]n(-c2cccc(Oc3cccc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C23H24N6O4.C23H24N6S4.C20H6N10O.C19H16N6.4Pt/c2*1-23(2,15-9-7-11-17(26-15)28-13-24-19(30-3)21(28)32-5)16-10-8-12-18(27-16)29-14-25-20(31-4)22(29)33-6;1-23-19-20(24-2)30(12-26-19)16-6-4-8-18(28-16)31-17-7-3-5-15(27-17)29-11-25-13(9-21)14(29)10-22;1-19(2,15-5-3-7-17(22-15)24-11-9-20-13-24)16-6-4-8-18(23-16)25-12-10-21-14-25;;;;/h2*7-12H,1-6H3;3-8H;3-12H,1-2H3;;;;/q4*-2;4*+2
InChIKeyCKRYYAGZZJGHAH-UHFFFAOYSA-N
MW2472.27 g/mol
LogP14.32
Rot. Bonds24

About 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))

2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)) (PubChem CID 161109962) has the molecular formula C85H70N28O5Pt4S4 and a molecular weight of 2472.27 g/mol. Its IUPAC name is 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)).

Molecular Properties

Compound Name2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))
PubChem CID161109962
Molecular FormulaC85H70N28O5Pt4S4
Molecular Weight2472.27 g/mol
Exact Mass2470.36
IUPAC Name2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))
SMILESCC(C)(c1cccc(-n2[c-]ncc2)n1)c1cccc(-n2[c-]ncc2)n1.COc1n[c-]n(-c2cccc(C(C)(C)c3cccc(-n4[c-]nc(OC)c4OC)n3)n2)c1OC.CSc1n[c-]n(-c2cccc(C(C)(C)c3cccc(-n4[c-]nc(SC)c4SC)n3)n2)c1SC.[C-]#[N+]c1n[c-]n(-c2cccc(Oc3cccc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C23H24N6O4.C23H24N6S4.C20H6N10O.C19H16N6.4Pt/c2*1-23(2,15-9-7-11-17(26-15)28-13-24-19(30-3)21(28)32-5)16-10-8-12-18(27-16)29-14-25-20(31-4)22(29)33-6;1-23-19-20(24-2)30(12-26-19)16-6-4-8-18(28-16)31-17-7-3-5-15(27-17)29-11-25-13(9-21)14(29)10-22;1-19(2,15-5-3-7-17(22-15)24-11-9-20-13-24)16-6-4-8-18(23-16)25-12-10-21-14-25;;;;/h2*7-12H,1-6H3;3-8H;3-12H,1-2H3;;;;/q4*-2;4*+2
InChIKeyCKRYYAGZZJGHAH-UHFFFAOYSA-N
XLogP14.32
TPSA348.13 Ų
H-Bond Donors
H-Bond Acceptors35
Rotatable Bonds24
Heavy Atoms126
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002472.27
LogP ≤ 514.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

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

Analyze 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))?
The IUPAC name of 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)) (CID 161109962) is 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)).
What is the SMILES notation for 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))?
The canonical SMILES for 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)) is CC(C)(c1cccc(-n2[c-]ncc2)n1)c1cccc(-n2[c-]ncc2)n1.COc1n[c-]n(-c2cccc(C(C)(C)c3cccc(-n4[c-]nc(OC)c4OC)n3)n2)c1OC.CSc1n[c-]n(-c2cccc(C(C)(C)c3cccc(-n4[c-]nc(SC)c4SC)n3)n2)c1SC.[C-]#[N+]c1n[c-]n(-c2cccc(Oc3cccc(-n4[c-]nc(C#N)c4C#N)n3)n2)c1[N+]#[C-].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))?
The InChIKey is CKRYYAGZZJGHAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O4.C23H24N6S4.C20H6N10O.C19H16N6.4Pt/c2*1-23(2,15-9-7-11-17(26-15)28-13-24-19(30-3)21(28)32-5)16-10-8-12-18(27-16)29-14-25-20(31-4)22(29)33-6;1-23-19-20(24-2)30(12-26-19)16-6-4-8-18(28-16)31-17-7-3-5-15(27-17)29-11-25-13(9-21)14(29)10-22;1-19(2,15-5-3-7-17(22-15)24-11-9-20-13-24)16-6-4-8-18(23-16)25-12-10-21-14-25;;;;/h2*7-12H,1-6H3;3-8H;3-12H,1-2H3;;;;/q4*-2;4*+2.
What are the key properties of 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+))?
2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)) has a molecular weight of 2472.27 g/mol, XLogP of 14.32, 24 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4,5-bis(methylsulfanyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;1-[6-[[6-(4,5-diisocyano-2H-imidazol-2-id-1-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2H-imidazol-2-ide-4,5-dicarbonitrile;2-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-6-[2-[6-(4,5-dimethoxy-2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;2-(2H-imidazol-2-id-1-yl)-6-[2-[6-(2H-imidazol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;tetrakis(platinum(2+)) is sourced from PubChem (CID 161109962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).