N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide

C93H79Cl4N17O12S4 — CID 159919796

About N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide

N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide (PubChem CID 159919796) has the molecular formula C93H79Cl4N17O12S4 and a molecular weight of 1896.84 g/mol. Its IUPAC name is N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide.

Molecular Properties

• Compound Name: N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide
• PubChem CID: 159919796
• Molecular Formula: C93H79Cl4N17O12S4
• Molecular Weight: 1896.84 g/mol
• Exact Mass: 1893.37
• IUPAC Name: N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide
• SMILES: Cc1cn(CCS(=O)(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)cn1.Cc1ncn(CCS(=O)(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)n1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(S(=O)(=O)CCn2cccn2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(S(=O)(=O)CCn2ccnc2)cc1
• InChI: InChI=1S/C24H21ClN4O3S.C23H20ClN5O3S.2C23H19ClN4O3S/c1-17-15-29(16-27-17)12-13-33(31,32)20-8-5-18(6-9-20)24(30)28-19-7-10-22(25)21(14-19)23-4-2-3-11-26-23;1-16-26-15-29(28-16)12-13-33(31,32)19-8-5-17(6-9-19)23(30)27-18-7-10-21(24)20(14-18)22-4-2-3-11-25-22;24-21-10-7-18(16-20(21)22-4-1-2-11-25-22)27-23(29)17-5-8-19(9-6-17)32(30,31)15-14-28-13-3-12-26-28;24-21-9-6-18(15-20(21)22-3-1-2-10-26-22)27-23(29)17-4-7-19(8-5-17)32(30,31)14-13-28-12-11-25-16-28/h2-11,14-16H,12-13H2,1H3,(H,28,30);2-11,14-15H,12-13H2,1H3,(H,27,30);1-13,16H,14-15H2,(H,27,29);1-12,15-16H,13-14H2,(H,27,29)
• InChIKey: NYGCXXCJECOJOZ-UHFFFAOYSA-N
• XLogP: 17.31
• TPSA: 388.69 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 25
• Rotatable Bonds: 28
• Heavy Atoms: 130
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1896.84
LogP ≤ 5	17.31
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide?

The IUPAC name of N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide (CID 159919796) is N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide.

What is the SMILES notation for N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide?

The canonical SMILES for N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide is Cc1cn(CCS(=O)(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)cn1.Cc1ncn(CCS(=O)(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)n1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(S(=O)(=O)CCn2cccn2)cc1.O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(S(=O)(=O)CCn2ccnc2)cc1.

What is the InChIKey of N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide?

The InChIKey is NYGCXXCJECOJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClN4O3S.C23H20ClN5O3S.2C23H19ClN4O3S/c1-17-15-29(16-27-17)12-13-33(31,32)20-8-5-18(6-9-20)24(30)28-19-7-10-22(25)21(14-19)23-4-2-3-11-26-23;1-16-26-15-29(28-16)12-13-33(31,32)19-8-5-17(6-9-19)23(30)27-18-7-10-21(24)20(14-18)22-4-2-3-11-25-22;24-21-10-7-18(16-20(21)22-4-1-2-11-25-22)27-23(29)17-5-8-19(9-6-17)32(30,31)15-14-28-13-3-12-26-28;24-21-9-6-18(15-20(21)22-3-1-2-10-26-22)27-23(29)17-4-7-19(8-5-17)32(30,31)14-13-28-12-11-25-16-28/h2-11,14-16H,12-13H2,1H3,(H,28,30);2-11,14-15H,12-13H2,1H3,(H,27,30);1-13,16H,14-15H2,(H,27,29);1-12,15-16H,13-14H2,(H,27,29).

What are the key properties of N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide?

N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide has a molecular weight of 1896.84 g/mol, XLogP of 17.31, 28 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-imidazol-1-ylethylsulfonyl)benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(4-methylimidazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-[2-(3-methyl-1,2,4-triazol-1-yl)ethylsulfonyl]benzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-(2-pyrazol-1-ylethylsulfonyl)benzamide is sourced from PubChem (CID 159919796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).