N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide

C90H73F6N21O10S2 — CID 158399694

About N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide

N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide (PubChem CID 158399694) has the molecular formula C90H73F6N21O10S2 and a molecular weight of 1786.83 g/mol. Its IUPAC name is N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide.

Molecular Properties

• Compound Name: N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide
• PubChem CID: 158399694
• Molecular Formula: C90H73F6N21O10S2
• Molecular Weight: 1786.83 g/mol
• Exact Mass: 1785.52
• IUPAC Name: N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide
• SMILES: Cc1ccccc1C(=O)Nc1nc(CCc2ccccc2)nn1-c1ccccc1.Cc1ccccc1C(=O)Nc1nc(NC(=O)c2cccnc2)nn1-c1ccc(OC(F)(F)F)cc1.Cc1ccccc1C(=O)Nc1nc(NC(=O)c2ccncc2)nn1-c1ccc(C(F)(F)F)cc1.O=S(=O)(Nc1nc(NS(=O)(=O)c2ccccc2)n(-c2ccccc2)n1)c1ccccc1
• InChI: InChI=1S/C24H22N4O.C23H17F3N6O3.C23H17F3N6O2.C20H17N5O4S2/c1-18-10-8-9-15-21(18)23(29)26-24-25-22(17-16-19-11-4-2-5-12-19)27-28(24)20-13-6-3-7-14-20;1-14-5-2-3-7-18(14)20(34)29-22-30-21(28-19(33)15-6-4-12-27-13-15)31-32(22)16-8-10-17(11-9-16)35-23(24,25)26;1-14-4-2-3-5-18(14)20(34)29-22-30-21(28-19(33)15-10-12-27-13-11-15)31-32(22)17-8-6-16(7-9-17)23(24,25)26;26-30(27,17-12-6-2-7-13-17)23-19-21-20(25(22-19)16-10-4-1-5-11-16)24-31(28,29)18-14-8-3-9-15-18/h2-15H,16-17H2,1H3,(H,25,26,27,29);2-13H,1H3,(H2,28,29,30,31,33,34);2-13H,1H3,(H2,28,29,30,31,33,34);1-15H,(H2,21,22,23,24)
• InChIKey: GXYLHZIQGIZTCM-UHFFFAOYSA-N
• XLogP: 16.35
• TPSA: 395.69 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 24
• Rotatable Bonds: 24
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1786.83
LogP ≤ 5	16.35
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide?

The IUPAC name of N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide (CID 158399694) is N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide.

What is the SMILES notation for N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide?

The canonical SMILES for N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide is Cc1ccccc1C(=O)Nc1nc(CCc2ccccc2)nn1-c1ccccc1.Cc1ccccc1C(=O)Nc1nc(NC(=O)c2cccnc2)nn1-c1ccc(OC(F)(F)F)cc1.Cc1ccccc1C(=O)Nc1nc(NC(=O)c2ccncc2)nn1-c1ccc(C(F)(F)F)cc1.O=S(=O)(Nc1nc(NS(=O)(=O)c2ccccc2)n(-c2ccccc2)n1)c1ccccc1.

What is the InChIKey of N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide?

The InChIKey is GXYLHZIQGIZTCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O.C23H17F3N6O3.C23H17F3N6O2.C20H17N5O4S2/c1-18-10-8-9-15-21(18)23(29)26-24-25-22(17-16-19-11-4-2-5-12-19)27-28(24)20-13-6-3-7-14-20;1-14-5-2-3-7-18(14)20(34)29-22-30-21(28-19(33)15-6-4-12-27-13-15)31-32(22)16-8-10-17(11-9-16)35-23(24,25)26;1-14-4-2-3-5-18(14)20(34)29-22-30-21(28-19(33)15-10-12-27-13-11-15)31-32(22)17-8-6-16(7-9-17)23(24,25)26;26-30(27,17-12-6-2-7-13-17)23-19-21-20(25(22-19)16-10-4-1-5-11-16)24-31(28,29)18-14-8-3-9-15-18/h2-15H,16-17H2,1H3,(H,25,26,27,29);2-13H,1H3,(H2,28,29,30,31,33,34);2-13H,1H3,(H2,28,29,30,31,33,34);1-15H,(H2,21,22,23,24).

What are the key properties of N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide?

N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide has a molecular weight of 1786.83 g/mol, XLogP of 16.35, 24 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(benzenesulfonamido)-1-phenyl-1,2,4-triazol-3-yl]benzenesulfonamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]pyridine-3-carboxamide;N-[5-[(2-methylbenzoyl)amino]-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]pyridine-4-carboxamide;2-methyl-N-[2-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]benzamide is sourced from PubChem (CID 158399694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).