About 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+))
10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+)) (PubChem CID 158971124) has the molecular formula C169H129FN24Pt4
and a molecular weight of 3295.37 g/mol. Its IUPAC name is 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+)).
Frequently Asked Questions
What is the IUPAC name of 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+))?
The IUPAC name of 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+)) (CID 158971124) is 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+)).
What is the SMILES notation for 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+))?
The canonical SMILES for 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+)) is Cc1cc(C)c(-n2c(C)nnc2-c2[c-]c(-n3c4ccccc4c4cc5c6ccccc6n(-c6[c-]ccc(C(C)C)c6)c5nc43)ccc2)c(C)c1.Cc1cc(C)c(-n2nc(C)nc2-c2[c-]c(-n3c4ccccc4c4cc5c6ccccc6n(-c6[c-]cccc6)c5nc43)ccc2)c(C)c1.Cc1cc[c-]c(-n2c3ccccc3c3cc4c5ccccc5n(-c5[c-]c(-n6nc(C)nc6C)ccc5F)c4nc32)c1.Cc1ccccc1-c1nnc(-c2[c-]c(-n3c4ccccc4c4cc5c6ccccc6n(-c6[c-]cccc6)c5nc43)ccc2)n1-c1c(C(C)C)cccc1C(C)C.[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+))?
The InChIKey is VYGCFYHVZYJUDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H40N6.C44H36N6.C41H30N6.C34H23FN6.4Pt/c1-31(2)37-25-16-26-38(32(3)4)46(37)56-47(52-53-50(56)39-22-10-9-17-33(39)5)34-18-15-21-36(29-34)55-45-28-14-12-24-41(45)43-30-42-40-23-11-13-27-44(40)54(48(42)51-49(43)55)35-19-7-6-8-20-35;1-26(2)31-13-11-15-33(23-31)49-39-19-9-7-17-35(39)37-25-38-36-18-8-10-20-40(36)50(44(38)45-43(37)49)34-16-12-14-32(24-34)42-47-46-30(6)48(42)41-28(4)21-27(3)22-29(41)5;1-25-21-26(2)38(27(3)22-25)47-39(42-28(4)44-47)29-13-12-16-31(23-29)46-37-20-11-9-18-33(37)35-24-34-32-17-8-10-19-36(32)45(40(34)43-41(35)46)30-14-6-5-7-15-30;1-20-9-8-10-23(17-20)39-30-13-6-4-11-25(30)27-19-28-26-12-5-7-14-31(26)40(34(28)37-33(27)39)32-18-24(15-16-29(32)35)41-22(3)36-21(2)38-41;;;;/h6-19,21-28,30-32H,1-5H3;7-14,16-23,25-26H,1-6H3;5-14,16-22,24H,1-4H3;4-9,11-17,19H,1-3H3;;;;/q4*-2;4*+2.
What are the key properties of 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+))?
10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+)) has a molecular weight of 3295.37 g/mol, XLogP of 39.70, 19 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[5-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobenzene-6-id-1-yl]-14-(3-methylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[4-[2,6-di(propan-2-yl)phenyl]-5-(2-methylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-2-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4,6,8,12,15,17,19-nonaene;10-[3-[5-methyl-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]-14-(3-propan-2-ylbenzene-6-id-1-yl)-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene;tetrakis(platinum(2+)) is sourced from PubChem (CID 158971124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).