1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))

C179H96F12N30O6Pt5S4 — CID 157245637

IUPAC1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))
SMILESCC(C)(c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C(F)(F)F)c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C(F)(F)F.[C-]#[N+]c1ccc2oc3c[c-]c(-n4cc(C(F)(F)F)c(C(C)(C)c5nn(-c6[c-]cc7oc8ccc(C#N)cc8c7c6)cc5C(F)(F)F)n4)cc3c2c1.[C-]#[N+]c1ccc2oc3c[c-]c(-n4cc([N+]#[C-])c(C(C)(C)c5nn(-c6[c-]cc7oc8ccc(C#N)cc8c7c6)cc5C#N)n4)cc3c2c1.[C-]#[N+]c1cn(-c2[c-]cc3oc4ccccc4c3c2)nc1C(C)(C)c1nn(-c2[c-]cc3oc4ccccc4c3c2)cc1C#N.[C-]#[N+]c1cn(-c2[c-]cc3sc4ccccc4c3c2)nc1C(C)(C)c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C#N.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C37H18F6N6O2.C37H18N8O2.C35H20F6N4S2.C35H20N6O2.C35H20N6S2.5Pt/c1-35(2,33-27(36(38,39)40)17-48(46-33)21-6-10-31-25(14-21)23-12-19(16-44)4-8-29(23)50-31)34-28(37(41,42)43)18-49(47-34)22-7-11-32-26(15-22)24-13-20(45-3)5-9-30(24)51-32;1-37(2,35-22(18-39)19-44(42-35)24-7-11-33-28(15-24)26-13-21(17-38)5-9-31(26)46-33)36-30(41-4)20-45(43-36)25-8-12-34-29(16-25)27-14-23(40-3)6-10-32(27)47-34;1-33(2,31-25(34(36,37)38)17-44(42-31)19-11-13-29-23(15-19)21-7-3-5-9-27(21)46-29)32-26(35(39,40)41)18-45(43-32)20-12-14-30-24(16-20)22-8-4-6-10-28(22)47-30;2*1-35(2,33-21(18-36)19-40(38-33)22-12-14-31-26(16-22)24-8-4-6-10-29(24)42-31)34-28(37-3)20-41(39-34)23-13-15-32-27(17-23)25-9-5-7-11-30(25)43-32;;;;;/h4-5,8-15,17-18H,1-2H3;5-6,9-16,19-20H,1-2H3;3-10,13-18H,1-2H3;2*4-11,14-17,19-20H,1-2H3;;;;;/q5*-2;5*+2
InChIKeyWWGIEVVEAFOEOU-UHFFFAOYSA-N
MW4094.57 g/mol
LogP46.96
Rot. Bonds20

About 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))

1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)) (PubChem CID 157245637) has the molecular formula C179H96F12N30O6Pt5S4 and a molecular weight of 4094.57 g/mol. Its IUPAC name is 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)).

Molecular Properties

Compound Name1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))
PubChem CID157245637
Molecular FormulaC179H96F12N30O6Pt5S4
Molecular Weight4094.57 g/mol
Exact Mass4091.51
IUPAC Name1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))
SMILESCC(C)(c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C(F)(F)F)c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C(F)(F)F.[C-]#[N+]c1ccc2oc3c[c-]c(-n4cc(C(F)(F)F)c(C(C)(C)c5nn(-c6[c-]cc7oc8ccc(C#N)cc8c7c6)cc5C(F)(F)F)n4)cc3c2c1.[C-]#[N+]c1ccc2oc3c[c-]c(-n4cc([N+]#[C-])c(C(C)(C)c5nn(-c6[c-]cc7oc8ccc(C#N)cc8c7c6)cc5C#N)n4)cc3c2c1.[C-]#[N+]c1cn(-c2[c-]cc3oc4ccccc4c3c2)nc1C(C)(C)c1nn(-c2[c-]cc3oc4ccccc4c3c2)cc1C#N.[C-]#[N+]c1cn(-c2[c-]cc3sc4ccccc4c3c2)nc1C(C)(C)c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C#N.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C37H18F6N6O2.C37H18N8O2.C35H20F6N4S2.C35H20N6O2.C35H20N6S2.5Pt/c1-35(2,33-27(36(38,39)40)17-48(46-33)21-6-10-31-25(14-21)23-12-19(16-44)4-8-29(23)50-31)34-28(37(41,42)43)18-49(47-34)22-7-11-32-26(15-22)24-13-20(45-3)5-9-30(24)51-32;1-37(2,35-22(18-39)19-44(42-35)24-7-11-33-28(15-24)26-13-21(17-38)5-9-31(26)46-33)36-30(41-4)20-45(43-36)25-8-12-34-29(16-25)27-14-23(40-3)6-10-32(27)47-34;1-33(2,31-25(34(36,37)38)17-44(42-31)19-11-13-29-23(15-19)21-7-3-5-9-27(21)46-29)32-26(35(39,40)41)18-45(43-32)20-12-14-30-24(16-20)22-8-4-6-10-28(22)47-30;2*1-35(2,33-21(18-36)19-40(38-33)22-12-14-31-26(16-22)24-8-4-6-10-29(24)42-31)34-28(37-3)20-41(39-34)23-13-15-32-27(17-23)25-9-5-7-11-30(25)43-32;;;;;/h4-5,8-15,17-18H,1-2H3;5-6,9-16,19-20H,1-2H3;3-10,13-18H,1-2H3;2*4-11,14-17,19-20H,1-2H3;;;;;/q5*-2;5*+2
InChIKeyWWGIEVVEAFOEOU-UHFFFAOYSA-N
XLogP46.96
TPSA397.79 Ų
H-Bond Donors
H-Bond Acceptors35
Rotatable Bonds20
Heavy Atoms236
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004094.57
LogP ≤ 546.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

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

Analyze 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-dibenzofuran-3-ylphenyl)-diphenyl-(9-phenylcarbazol-1-yl)silane;(4-dibenzofuran-3-ylphenyl)-diphenyl-(9-phenylcarbazol-1-yl)silane;(4-dibenzothiophen-3-ylphenyl)-diphenyl-(9-phenylcarbazol-1-yl)silane;9-[3-[diphenyl-(9-phenylcarbazol-1-yl)silyl]phenyl]-6-isocyanocarbazole-3-carbonitrile
CID 159899285
9-[8-(2-isocyano-[1]benzofuro[3,2-b]carbazol-11-yl)dibenzofuran-2-yl]carbazole-3-carbonitrile
CID 140822958
9-[2-[2-([1]benzothiolo[3,2-b]carbazol-11-yl)phenyl]phenyl]-6-isocyanocarbazole-3-carbonitrile
CID 140822705
2-(3-dibenzofuran-3-yl-5-dibenzothiophen-3-ylphenyl)benzene-1,4-dicarbonitrile
CID 146355597
9-[2-[2-(2-isocyano-[1]benzofuro[3,2-b]carbazol-11-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 140823103
9-[3-[2-[3-(8-isocyano-[1]benzothiolo[3,2-b]carbazol-11-yl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile
CID 140823139
7-(4-dibenzofuran-3-yl-6-dibenzothiophen-3-yl-1,3,5-triazin-2-yl)dibenzofuran-3-carbonitrile
CID 138736824
9-[6-(2-isocyano-[1]benzothiolo[2,3-b]carbazol-7-yl)-2-pyridinyl]carbazole-3-carbonitrile
CID 140822672
9-[8-([1]benzofuro[3,2-c]carbazol-5-yl)dibenzothiophen-2-yl]-6-isocyanocarbazole-3-carbonitrile;9-[8-([1]benzothiolo[3,2-c]carbazol-5-yl)dibenzothiophen-2-yl]carbazole-3,6-dicarbonitrile;9-[8-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)dibenzofuran-2-yl]carbazole-3,6-dicarbonitrile;9-[8-(7-phenylindolo[2,3-b]carbazol-5-yl)dibenzofuran-2-yl]carbazole-3,6-dicarbonitrile
CID 158260118
5-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)benzene-1,3-dicarbonitrile
CID 146355100
3-(3-dibenzofuran-2-yl-4-dibenzothiophen-2-ylphenyl)benzonitrile
CID 146355675
9-[5-[2,4-bis(trifluoromethyl)phenyl]-2-cyano-4-(3-isocyanocarbazol-9-yl)phenyl]carbazole-3-carbonitrile
CID 153423014

Frequently Asked Questions

What is the IUPAC name of 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))?
The IUPAC name of 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)) (CID 157245637) is 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)).
What is the SMILES notation for 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))?
The canonical SMILES for 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)) is CC(C)(c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C(F)(F)F)c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C(F)(F)F.[C-]#[N+]c1ccc2oc3c[c-]c(-n4cc(C(F)(F)F)c(C(C)(C)c5nn(-c6[c-]cc7oc8ccc(C#N)cc8c7c6)cc5C(F)(F)F)n4)cc3c2c1.[C-]#[N+]c1ccc2oc3c[c-]c(-n4cc([N+]#[C-])c(C(C)(C)c5nn(-c6[c-]cc7oc8ccc(C#N)cc8c7c6)cc5C#N)n4)cc3c2c1.[C-]#[N+]c1cn(-c2[c-]cc3oc4ccccc4c3c2)nc1C(C)(C)c1nn(-c2[c-]cc3oc4ccccc4c3c2)cc1C#N.[C-]#[N+]c1cn(-c2[c-]cc3sc4ccccc4c3c2)nc1C(C)(C)c1nn(-c2[c-]cc3sc4ccccc4c3c2)cc1C#N.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))?
The InChIKey is WWGIEVVEAFOEOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H18F6N6O2.C37H18N8O2.C35H20F6N4S2.C35H20N6O2.C35H20N6S2.5Pt/c1-35(2,33-27(36(38,39)40)17-48(46-33)21-6-10-31-25(14-21)23-12-19(16-44)4-8-29(23)50-31)34-28(37(41,42)43)18-49(47-34)22-7-11-32-26(15-22)24-13-20(45-3)5-9-30(24)51-32;1-37(2,35-22(18-39)19-44(42-35)24-7-11-33-28(15-24)26-13-21(17-38)5-9-31(26)46-33)36-30(41-4)20-45(43-36)25-8-12-34-29(16-25)27-14-23(40-3)6-10-32(27)47-34;1-33(2,31-25(34(36,37)38)17-44(42-31)19-11-13-29-23(15-19)21-7-3-5-9-27(21)46-29)32-26(35(39,40)41)18-45(43-32)20-12-14-30-24(16-20)22-8-4-6-10-28(22)47-30;2*1-35(2,33-21(18-36)19-40(38-33)22-12-14-31-26(16-22)24-8-4-6-10-29(24)42-31)34-28(37-3)20-41(39-34)23-13-15-32-27(17-23)25-9-5-7-11-30(25)43-32;;;;;/h4-5,8-15,17-18H,1-2H3;5-6,9-16,19-20H,1-2H3;3-10,13-18H,1-2H3;2*4-11,14-17,19-20H,1-2H3;;;;;/q5*-2;5*+2.
What are the key properties of 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+))?
1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)) has a molecular weight of 4094.57 g/mol, XLogP of 46.96, 20 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-cyano-3H-dibenzofuran-3-id-2-yl)-3-[2-[4-isocyano-1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-isocyanopyrazol-3-yl]propan-2-yl]pyrazole-4-carbonitrile;1-(3H-dibenzothiophen-3-id-2-yl)-3-[2-[1-(3H-dibenzothiophen-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazole;8-[3-[2-[1-(8-isocyano-3H-dibenzofuran-3-id-2-yl)-4-(trifluoromethyl)pyrazol-3-yl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]-7H-dibenzofuran-7-ide-2-carbonitrile;pentakis(platinum(2+)) is sourced from PubChem (CID 157245637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).