N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide

C97H115Cl8N9O19S8 — CID 161407583

About N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide

N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide (PubChem CID 161407583) has the molecular formula C97H115Cl8N9O19S8 and a molecular weight of 2251.19 g/mol. Its IUPAC name is N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide.

Molecular Properties

• Compound Name: N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide
• PubChem CID: 161407583
• Molecular Formula: C97H115Cl8N9O19S8
• Molecular Weight: 2251.19 g/mol
• Exact Mass: 2245.36
• IUPAC Name: N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide
• SMILES: CC(=O)CCCCCCN(CCCc1cc(Cl)cc(Cl)c1)S(C)(=O)=O.CC(=O)COc1cccc(CN(Cc2ccc(-n3cccn3)cc2)S(=O)(=O)c2cccnc2)c1.CC(=O)c1ccc(CCCN(CCCOc2cc(Cl)cc(Cl)c2)S(C)(=O)=O)s1.CC(=O)c1ccc(CCCN(CCOc2cc(Cl)cc(Cl)c2)S(C)(=O)=O)s1.CC(=O)c1csc(CCCN(CCOc2cc(Cl)cc(Cl)c2)S(C)(=O)=O)n1
• InChI: InChI=1S/C25H24N4O4S.C19H23Cl2NO4S2.C18H21Cl2NO4S2.C18H27Cl2NO3S.C17H20Cl2N2O4S2/c1-20(30)19-33-24-6-2-5-22(15-24)18-28(34(31,32)25-7-3-12-26-16-25)17-21-8-10-23(11-9-21)29-14-4-13-27-29;1-14(23)19-7-6-18(27-19)5-3-8-22(28(2,24)25)9-4-10-26-17-12-15(20)11-16(21)13-17;1-13(22)18-6-5-17(26-18)4-3-7-21(27(2,23)24)8-9-25-16-11-14(19)10-15(20)12-16;1-15(22)8-5-3-4-6-10-21(25(2,23)24)11-7-9-16-12-17(19)14-18(20)13-16;1-12(22)16-11-26-17(20-16)4-3-5-21(27(2,23)24)6-7-25-15-9-13(18)8-14(19)10-15/h2-16H,17-19H2,1H3;6-7,11-13H,3-5,8-10H2,1-2H3;5-6,10-12H,3-4,7-9H2,1-2H3;12-14H,3-11H2,1-2H3;8-11H,3-7H2,1-2H3
• InChIKey: VVAVCYUDGOFWOJ-UHFFFAOYSA-N
• XLogP: 21.73
• TPSA: 352.77 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 53
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2251.19
LogP ≤ 5	21.73
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide?

The IUPAC name of N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide (CID 161407583) is N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide.

What is the SMILES notation for N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide?

The canonical SMILES for N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide is CC(=O)CCCCCCN(CCCc1cc(Cl)cc(Cl)c1)S(C)(=O)=O.CC(=O)COc1cccc(CN(Cc2ccc(-n3cccn3)cc2)S(=O)(=O)c2cccnc2)c1.CC(=O)c1ccc(CCCN(CCCOc2cc(Cl)cc(Cl)c2)S(C)(=O)=O)s1.CC(=O)c1ccc(CCCN(CCOc2cc(Cl)cc(Cl)c2)S(C)(=O)=O)s1.CC(=O)c1csc(CCCN(CCOc2cc(Cl)cc(Cl)c2)S(C)(=O)=O)n1.

What is the InChIKey of N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide?

The InChIKey is VVAVCYUDGOFWOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O4S.C19H23Cl2NO4S2.C18H21Cl2NO4S2.C18H27Cl2NO3S.C17H20Cl2N2O4S2/c1-20(30)19-33-24-6-2-5-22(15-24)18-28(34(31,32)25-7-3-12-26-16-25)17-21-8-10-23(11-9-21)29-14-4-13-27-29;1-14(23)19-7-6-18(27-19)5-3-8-22(28(2,24)25)9-4-10-26-17-12-15(20)11-16(21)13-17;1-13(22)18-6-5-17(26-18)4-3-7-21(27(2,23)24)8-9-25-16-11-14(19)10-15(20)12-16;1-15(22)8-5-3-4-6-10-21(25(2,23)24)11-7-9-16-12-17(19)14-18(20)13-16;1-12(22)16-11-26-17(20-16)4-3-5-21(27(2,23)24)6-7-25-15-9-13(18)8-14(19)10-15/h2-16H,17-19H2,1H3;6-7,11-13H,3-5,8-10H2,1-2H3;5-6,10-12H,3-4,7-9H2,1-2H3;12-14H,3-11H2,1-2H3;8-11H,3-7H2,1-2H3.

What are the key properties of N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide?

N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide has a molecular weight of 2251.19 g/mol, XLogP of 21.73, 53 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-(4-acetyl-1,3-thiazol-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[2-(3,5-dichlorophenoxy)ethyl]methanesulfonamide;N-[3-(5-acetylthiophen-2-yl)propyl]-N-[3-(3,5-dichlorophenoxy)propyl]methanesulfonamide;N-[3-(3,5-dichlorophenyl)propyl]-N-(7-oxooctyl)methanesulfonamide;N-[[3-(2-oxopropoxy)phenyl]methyl]-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 161407583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).