2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide

C104H74ClF27N31O7S7+3 — CID 161016183

About 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide

2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide (PubChem CID 161016183) has the molecular formula C104H74ClF27N31O7S7+3 and a molecular weight of 2642.81 g/mol. Its IUPAC name is 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide
• PubChem CID: 161016183
• Molecular Formula: C104H74ClF27N31O7S7+3
• Molecular Weight: 2642.81 g/mol
• Exact Mass: 2640.37
• IUPAC Name: 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide
• SMILES: C[N+]1=C(c2cnc(NC(=O)c3c(F)cccc3F)s2)CC(C(F)(F)F)=N1.Cc1ccc(C(=O)Nc2ncc(C3=[N+](C)N=C(C(F)(F)F)C3)s2)cc1.Cc1cccnc1C(=O)Nc1ncc(C2=[N+](C)N=C(C(F)(F)F)C2)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2c(F)cncc2F)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2Cl)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2F)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccncc2F)s1
• InChI: InChI=1S/C16H13F3N4OS.C15H10ClF3N4OS.C15H9F5N4OS.C15H10F4N4OS.C15H12F3N5OS.C14H8F5N5OS.C14H9F4N5OS/c1-9-3-5-10(6-4-9)14(24)21-15-20-8-12(25-15)11-7-13(16(17,18)19)22-23(11)2;1-23-10(6-12(22-23)15(17,18)19)11-7-20-14(25-11)21-13(24)8-4-2-3-5-9(8)16;1-24-9(5-11(23-24)15(18,19)20)10-6-21-14(26-10)22-13(25)12-7(16)3-2-4-8(12)17;1-23-10(6-12(22-23)15(17,18)19)11-7-20-14(25-11)21-13(24)8-4-2-3-5-9(8)16;1-8-4-3-5-19-12(8)13(24)21-14-20-7-10(25-14)9-6-11(15(16,17)18)22-23(9)2;1-24-8(2-10(23-24)14(17,18)19)9-5-21-13(26-9)22-12(25)11-6(15)3-20-4-7(11)16;1-23-9(4-11(22-23)14(16,17)18)10-6-20-13(25-10)21-12(24)7-2-3-19-5-8(7)15/h3-6,8H,7H2,1-2H3;2-7H,1H3,(H,20,21,24);2-4,6H,5H2,1H3;2-7H,1H3,(H,20,21,24);3-5,7H,6H2,1-2H3;2-5H,1H3,(H,21,22,25);2-6H,1H3,(H,20,21,24)/p+3
• InChIKey: NODGTZFOPOAGHN-UHFFFAOYSA-Q
• XLogP: 25.00
• TPSA: 449.99 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 35
• Rotatable Bonds: 21
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2642.81
LogP ≤ 5	25.00
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide?

The IUPAC name of 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide (CID 161016183) is 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide.

What is the SMILES notation for 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide?

The canonical SMILES for 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide is C[N+]1=C(c2cnc(NC(=O)c3c(F)cccc3F)s2)CC(C(F)(F)F)=N1.Cc1ccc(C(=O)Nc2ncc(C3=[N+](C)N=C(C(F)(F)F)C3)s2)cc1.Cc1cccnc1C(=O)Nc1ncc(C2=[N+](C)N=C(C(F)(F)F)C2)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2c(F)cncc2F)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2Cl)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2F)s1.Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccncc2F)s1.

What is the InChIKey of 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide?

The InChIKey is NODGTZFOPOAGHN-UHFFFAOYSA-Q. The full InChI is InChI=1S/C16H13F3N4OS.C15H10ClF3N4OS.C15H9F5N4OS.C15H10F4N4OS.C15H12F3N5OS.C14H8F5N5OS.C14H9F4N5OS/c1-9-3-5-10(6-4-9)14(24)21-15-20-8-12(25-15)11-7-13(16(17,18)19)22-23(11)2;1-23-10(6-12(22-23)15(17,18)19)11-7-20-14(25-11)21-13(24)8-4-2-3-5-9(8)16;1-24-9(5-11(23-24)15(18,19)20)10-6-21-14(26-10)22-13(25)12-7(16)3-2-4-8(12)17;1-23-10(6-12(22-23)15(17,18)19)11-7-20-14(25-11)21-13(24)8-4-2-3-5-9(8)16;1-8-4-3-5-19-12(8)13(24)21-14-20-7-10(25-14)9-6-11(15(16,17)18)22-23(9)2;1-24-8(2-10(23-24)14(17,18)19)9-5-21-13(26-9)22-12(25)11-6(15)3-20-4-7(11)16;1-23-9(4-11(22-23)14(16,17)18)10-6-20-13(25-10)21-12(24)7-2-3-19-5-8(7)15/h3-6,8H,7H2,1-2H3;2-7H,1H3,(H,20,21,24);2-4,6H,5H2,1H3;2-7H,1H3,(H,20,21,24);3-5,7H,6H2,1-2H3;2-5H,1H3,(H,21,22,25);2-6H,1H3,(H,20,21,24)/p+3.

What are the key properties of 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide?

2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide has a molecular weight of 2642.81 g/mol, XLogP of 25.00, 21 rotatable bonds, 7 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]benzamide;3-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide;4-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]benzamide;3-methyl-N-[5-[2-methyl-5-(trifluoromethyl)-4H-pyrazol-2-ium-3-yl]-1,3-thiazol-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 161016183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).