2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole

C86H67ClF9N31O9 — CID 162112740

About 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole

2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole (PubChem CID 162112740) has the molecular formula C86H67ClF9N31O9 and a molecular weight of 1885.12 g/mol. Its IUPAC name is 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole.

Molecular Properties

• Compound Name: 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole
• PubChem CID: 162112740
• Molecular Formula: C86H67ClF9N31O9
• Molecular Weight: 1885.12 g/mol
• Exact Mass: 1883.53
• IUPAC Name: 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole
• SMILES: Cc1cc(-c2ncn(/C=C\c3nnco3)n2)cc(C(F)(F)F)c1.Cc1cc(C#N)cc(-c2ncn(/C=C\c3nnco3)n2)c1.Cc1cc(O)cc(-c2ncn(/C=C\c3nnco3)n2)c1.Cc1cc(OC(C)C)cc(-c2ncn(/C=C\c3ccccn3)n2)c1.Cc1cc(OC(F)(F)F)cc(-c2ncn(/C=C\c3nnco3)n2)c1.FC(F)(F)Oc1cc(-c2ncn(/C=C\c3nnco3)n2)cc(Cl)n1
• InChI: InChI=1S/C19H20N4O.C14H10F3N5O2.C14H10F3N5O.C14H10N6O.C13H11N5O2.C12H6ClF3N6O2/c1-14(2)24-18-11-15(3)10-16(12-18)19-21-13-23(22-19)9-7-17-6-4-5-8-20-17;1-9-4-10(6-11(5-9)24-14(15,16)17)13-18-7-22(21-13)3-2-12-20-19-8-23-12;1-9-4-10(6-11(5-9)14(15,16)17)13-18-7-22(21-13)3-2-12-20-19-8-23-12;1-10-4-11(7-15)6-12(5-10)14-16-8-20(19-14)3-2-13-18-17-9-21-13;1-9-4-10(6-11(19)5-9)13-14-7-18(17-13)3-2-12-16-15-8-20-12;13-8-3-7(4-10(19-8)24-12(14,15)16)11-17-5-22(21-11)2-1-9-20-18-6-23-9/h4-14H,1-3H3;2-8H,1H3;2-8H,1H3;2-6,8-9H,1H3;2-8,19H,1H3;1-6H/b9-7-;4*3-2-;2-1-
• InChIKey: ZGJCIAFNDNRNRG-UVIBQGMASA-N
• XLogP: 17.52
• TPSA: 476.35 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 40
• Rotatable Bonds: 22
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1885.12
LogP ≤ 5	17.52
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole?

The IUPAC name of 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole (CID 162112740) is 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole.

What is the SMILES notation for 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole?

The canonical SMILES for 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole is Cc1cc(-c2ncn(/C=C\c3nnco3)n2)cc(C(F)(F)F)c1.Cc1cc(C#N)cc(-c2ncn(/C=C\c3nnco3)n2)c1.Cc1cc(O)cc(-c2ncn(/C=C\c3nnco3)n2)c1.Cc1cc(OC(C)C)cc(-c2ncn(/C=C\c3ccccn3)n2)c1.Cc1cc(OC(F)(F)F)cc(-c2ncn(/C=C\c3nnco3)n2)c1.FC(F)(F)Oc1cc(-c2ncn(/C=C\c3nnco3)n2)cc(Cl)n1.

What is the InChIKey of 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole?

The InChIKey is ZGJCIAFNDNRNRG-UVIBQGMASA-N. The full InChI is InChI=1S/C19H20N4O.C14H10F3N5O2.C14H10F3N5O.C14H10N6O.C13H11N5O2.C12H6ClF3N6O2/c1-14(2)24-18-11-15(3)10-16(12-18)19-21-13-23(22-19)9-7-17-6-4-5-8-20-17;1-9-4-10(6-11(5-9)24-14(15,16)17)13-18-7-22(21-13)3-2-12-20-19-8-23-12;1-9-4-10(6-11(5-9)14(15,16)17)13-18-7-22(21-13)3-2-12-20-19-8-23-12;1-10-4-11(7-15)6-12(5-10)14-16-8-20(19-14)3-2-13-18-17-9-21-13;1-9-4-10(6-11(19)5-9)13-14-7-18(17-13)3-2-12-16-15-8-20-12;13-8-3-7(4-10(19-8)24-12(14,15)16)11-17-5-22(21-11)2-1-9-20-18-6-23-9/h4-14H,1-3H3;2-8H,1H3;2-8H,1H3;2-6,8-9H,1H3;2-8,19H,1H3;1-6H/b9-7-;4*3-2-;2-1-.

What are the key properties of 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole?

2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole has a molecular weight of 1885.12 g/mol, XLogP of 17.52, 22 rotatable bonds, 1 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(Z)-2-[3-[2-chloro-6-(trifluoromethoxy)-4-pyridinyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]benzonitrile;3-methyl-5-[1-[(Z)-2-(1,3,4-oxadiazol-2-yl)ethenyl]-1,2,4-triazol-3-yl]phenol;2-[(Z)-2-[3-(3-methyl-5-propan-2-yloxyphenyl)-1,2,4-triazol-1-yl]ethenyl]pyridine;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethoxy)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole;2-[(Z)-2-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]ethenyl]-1,3,4-oxadiazole is sourced from PubChem (CID 162112740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).