N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide

C103H71Cl8F13N14O15S5 — CID 172983390

About N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide

N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide (PubChem CID 172983390) has the molecular formula C103H71Cl8F13N14O15S5 and a molecular weight of 2435.72 g/mol. Its IUPAC name is N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide.

Molecular Properties

• Compound Name: N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
• PubChem CID: 172983390
• Molecular Formula: C103H71Cl8F13N14O15S5
• Molecular Weight: 2435.72 g/mol
• Exact Mass: 2430.11
• IUPAC Name: N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
• SMILES: CN(C(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(F)(F)F)c1)c1ccccn1.CO/N=C(/c1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccnc2[nH]ccc12.Cc1cc(S(=O)(=O)Nc2cc(Cl)ccc2C(=O)N(C)c2ccccn2)ccc1Cl.O=C(c1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccnc2[nH]ccc12.O=C(c1ccccc1)c1ccc(F)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1
• InChI: InChI=1S/C22H15Cl2F3N4O3S.C21H12Cl2F3N3O3S.C20H17Cl2N3O3S.C20H12ClF4NO3S.C20H15ClF3N3O3S/c1-34-30-20(14-6-8-28-21-15(14)7-9-29-21)16-4-2-12(23)10-19(16)31-35(32,33)13-3-5-18(24)17(11-13)22(25,26)27;22-11-1-3-15(19(30)13-5-7-27-20-14(13)6-8-28-20)18(9-11)29-33(31,32)12-2-4-17(23)16(10-12)21(24,25)26;1-13-11-15(7-9-17(13)22)29(27,28)24-18-12-14(21)6-8-16(18)20(26)25(2)19-5-3-4-10-23-19;21-17-9-7-14(11-16(17)20(23,24)25)30(28,29)26-18-10-13(22)6-8-15(18)19(27)12-4-2-1-3-5-12;1-27(18-7-2-3-10-25-18)19(28)16-9-8-14(21)12-17(16)26-31(29,30)15-6-4-5-13(11-15)20(22,23)24/h2-11,31H,1H3,(H,28,29);1-10,29H,(H,27,28);3-12,24H,1-2H3;1-11,26H;2-12,26H,1H3/b30-20+
• InChIKey: VIKZTKVTPKTLQW-KVFADGICSA-N
• XLogP: 27.14
• TPSA: 410.34 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 20
• Rotatable Bonds: 26
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2435.72
LogP ≤ 5	27.14
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?

The IUPAC name of N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide (CID 172983390) is N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide.

What is the SMILES notation for N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?

The canonical SMILES for N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide is CN(C(=O)c1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(F)(F)F)c1)c1ccccn1.CO/N=C(/c1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccnc2[nH]ccc12.Cc1cc(S(=O)(=O)Nc2cc(Cl)ccc2C(=O)N(C)c2ccccn2)ccc1Cl.O=C(c1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccnc2[nH]ccc12.O=C(c1ccccc1)c1ccc(F)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1.

What is the InChIKey of N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?

The InChIKey is VIKZTKVTPKTLQW-KVFADGICSA-N. The full InChI is InChI=1S/C22H15Cl2F3N4O3S.C21H12Cl2F3N3O3S.C20H17Cl2N3O3S.C20H12ClF4NO3S.C20H15ClF3N3O3S/c1-34-30-20(14-6-8-28-21-15(14)7-9-29-21)16-4-2-12(23)10-19(16)31-35(32,33)13-3-5-18(24)17(11-13)22(25,26)27;22-11-1-3-15(19(30)13-5-7-27-20-14(13)6-8-28-20)18(9-11)29-33(31,32)12-2-4-17(23)16(10-12)21(24,25)26;1-13-11-15(7-9-17(13)22)29(27,28)24-18-12-14(21)6-8-16(18)20(26)25(2)19-5-3-4-10-23-19;21-17-9-7-14(11-16(17)20(23,24)25)30(28,29)26-18-10-13(22)6-8-15(18)19(27)12-4-2-1-3-5-12;1-27(18-7-2-3-10-25-18)19(28)16-9-8-14(21)12-17(16)26-31(29,30)15-6-4-5-13(11-15)20(22,23)24/h2-11,31H,1H3,(H,28,29);1-10,29H,(H,27,28);3-12,24H,1-2H3;1-11,26H;2-12,26H,1H3/b30-20+;;;;.

What are the key properties of N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?

N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide has a molecular weight of 2435.72 g/mol, XLogP of 27.14, 26 rotatable bonds, 7 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-benzoyl-5-fluorophenyl)-4-chloro-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-[5-chloro-2-[(E)-N-methoxy-C-(1H-pyrrolo[2,3-b]pyridin-4-yl)carbonimidoyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-methyl-N-pyridin-2-ylbenzamide;4-chloro-N-[5-chloro-2-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide;4-chloro-N-methyl-N-pyridin-2-yl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide is sourced from PubChem (CID 172983390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).