N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide

C104H112Cl8F18N28O7S7 — CID 157462494

About N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide

N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide (PubChem CID 157462494) has the molecular formula C104H112Cl8F18N28O7S7 and a molecular weight of 2716.29 g/mol. Its IUPAC name is N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide.

Molecular Properties

• Compound Name: N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide
• PubChem CID: 157462494
• Molecular Formula: C104H112Cl8F18N28O7S7
• Molecular Weight: 2716.29 g/mol
• Exact Mass: 2710.45
• IUPAC Name: N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide
• SMILES: CCC(SCC(F)(F)F)C(=O)N(CC)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)C(C)SCC(F)(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)C(C)SCC(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)C(C)SCCF)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)CCSCC(F)(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)CSC(Cl)C(F)(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)CSCC(F)(F)F)c1cn(-c2cccnc2)nc1Cl
• InChI: InChI=1S/C16H18ClF3N4OS.2C15H16ClF3N4OS.C15H17ClF2N4OS.C15H18ClFN4OS.C14H13Cl2F3N4OS.C14H14ClF3N4OS/c1-3-13(26-10-16(18,19)20)15(25)23(4-2)12-9-24(22-14(12)17)11-6-5-7-21-8-11;1-3-22(14(24)10(2)25-9-15(17,18)19)12-8-23(21-13(12)16)11-5-4-6-20-7-11;1-2-22(13(24)5-7-25-10-15(17,18)19)12-9-23(21-14(12)16)11-4-3-6-20-8-11;1-3-21(15(23)10(2)24-9-13(17)18)12-8-22(20-14(12)16)11-5-4-6-19-7-11;1-3-20(15(22)11(2)23-8-6-17)13-10-21(19-14(13)16)12-5-4-7-18-9-12;1-2-22(11(24)8-25-13(16)14(17,18)19)10-7-23(21-12(10)15)9-4-3-5-20-6-9;1-2-21(12(23)8-24-9-14(16,17)18)11-7-22(20-13(11)15)10-4-3-5-19-6-10/h5-9,13H,3-4,10H2,1-2H3;4-8,10H,3,9H2,1-2H3;3-4,6,8-9H,2,5,7,10H2,1H3;4-8,10,13H,3,9H2,1-2H3;4-5,7,9-11H,3,6,8H2,1-2H3;3-7,13H,2,8H2,1H3;3-7H,2,8-9H2,1H3
• InChIKey: BUBZRBCNGXTHEP-UHFFFAOYSA-N
• XLogP: 26.99
• TPSA: 357.14 Ų
• H-Bond Acceptors: 35
• Rotatable Bonds: 46
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2716.29
LogP ≤ 5	26.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide?

The IUPAC name of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide (CID 157462494) is N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide.

What is the SMILES notation for N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide?

The canonical SMILES for N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide is CCC(SCC(F)(F)F)C(=O)N(CC)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)C(C)SCC(F)(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)C(C)SCC(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)C(C)SCCF)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)CCSCC(F)(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)CSC(Cl)C(F)(F)F)c1cn(-c2cccnc2)nc1Cl.CCN(C(=O)CSCC(F)(F)F)c1cn(-c2cccnc2)nc1Cl.

What is the InChIKey of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide?

The InChIKey is BUBZRBCNGXTHEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClF3N4OS.2C15H16ClF3N4OS.C15H17ClF2N4OS.C15H18ClFN4OS.C14H13Cl2F3N4OS.C14H14ClF3N4OS/c1-3-13(26-10-16(18,19)20)15(25)23(4-2)12-9-24(22-14(12)17)11-6-5-7-21-8-11;1-3-22(14(24)10(2)25-9-15(17,18)19)12-8-23(21-13(12)16)11-5-4-6-20-7-11;1-2-22(13(24)5-7-25-10-15(17,18)19)12-9-23(21-14(12)16)11-4-3-6-20-8-11;1-3-21(15(23)10(2)24-9-13(17)18)12-8-22(20-14(12)16)11-5-4-6-19-7-11;1-3-20(15(22)11(2)23-8-6-17)13-10-21(19-14(13)16)12-5-4-7-18-9-12;1-2-22(11(24)8-25-13(16)14(17,18)19)10-7-23(21-12(10)15)9-4-3-5-20-6-9;1-2-21(12(23)8-24-9-14(16,17)18)11-7-22(20-13(11)15)10-4-3-5-19-6-10/h5-9,13H,3-4,10H2,1-2H3;4-8,10H,3,9H2,1-2H3;3-4,6,8-9H,2,5,7,10H2,1H3;4-8,10,13H,3,9H2,1-2H3;4-5,7,9-11H,3,6,8H2,1-2H3;3-7,13H,2,8H2,1H3;3-7H,2,8-9H2,1H3.

What are the key properties of N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide?

N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide has a molecular weight of 2716.29 g/mol, XLogP of 26.99, 46 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(1-chloro-2,2,2-trifluoroethyl)sulfanyl-N-ethylacetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-2-(2,2-difluoroethylsulfanyl)-N-ethylpropanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2-fluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)acetamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)butanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-2-(2,2,2-trifluoroethylsulfanyl)propanamide;N-(3-chloro-1-pyridin-3-ylpyrazol-4-yl)-N-ethyl-3-(2,2,2-trifluoroethylsulfanyl)propanamide is sourced from PubChem (CID 157462494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).