4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide

C92H96N16O10S4 — CID 158062843

About 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide

4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide (PubChem CID 158062843) has the molecular formula C92H96N16O10S4 and a molecular weight of 1714.15 g/mol. Its IUPAC name is 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide.

Molecular Properties

• Compound Name: 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide
• PubChem CID: 158062843
• Molecular Formula: C92H96N16O10S4
• Molecular Weight: 1714.15 g/mol
• Exact Mass: 1712.64
• IUPAC Name: 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide
• SMILES: Cc1cc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)n(-c2cccc3cnccc23)n1.Cc1cc(NS(=O)(=O)c2ccc(OC(C)C)cc2)n(-c2cccc3ncccc23)n1.Cc1cc(NS(=O)(=O)c2ccc(OCC(C)C)cc2)n(-c2cccc3ncccc23)n1.Cc1ccc2c(-n3nc(C)cc3NS(=O)(=O)c3ccc(C(C)(C)C)cc3)cccc2n1
• InChI: InChI=1S/C24H26N4O2S.C23H24N4O3S.C23H24N4O2S.C22H22N4O3S/c1-16-9-14-20-21(25-16)7-6-8-22(20)28-23(15-17(2)26-28)27-31(29,30)19-12-10-18(11-13-19)24(3,4)5;1-16(2)15-30-18-9-11-19(12-10-18)31(28,29)26-23-14-17(3)25-27(23)22-8-4-7-21-20(22)6-5-13-24-21;1-16-14-22(26-30(28,29)19-10-8-18(9-11-19)23(2,3)4)27(25-16)21-7-5-6-17-15-24-13-12-20(17)21;1-15(2)29-17-9-11-18(12-10-17)30(27,28)25-22-14-16(3)24-26(22)21-8-4-7-20-19(21)6-5-13-23-20/h6-15,27H,1-5H3;4-14,16,26H,15H2,1-3H3;5-15,26H,1-4H3;4-15,25H,1-3H3
• InChIKey: FKVZGFGSADEIFI-UHFFFAOYSA-N
• XLogP: 18.84
• TPSA: 325.98 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 21
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1714.15
LogP ≤ 5	18.84
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide?

The IUPAC name of 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide (CID 158062843) is 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide.

What is the SMILES notation for 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide?

The canonical SMILES for 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide is Cc1cc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)n(-c2cccc3cnccc23)n1.Cc1cc(NS(=O)(=O)c2ccc(OC(C)C)cc2)n(-c2cccc3ncccc23)n1.Cc1cc(NS(=O)(=O)c2ccc(OCC(C)C)cc2)n(-c2cccc3ncccc23)n1.Cc1ccc2c(-n3nc(C)cc3NS(=O)(=O)c3ccc(C(C)(C)C)cc3)cccc2n1.

What is the InChIKey of 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide?

The InChIKey is FKVZGFGSADEIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O2S.C23H24N4O3S.C23H24N4O2S.C22H22N4O3S/c1-16-9-14-20-21(25-16)7-6-8-22(20)28-23(15-17(2)26-28)27-31(29,30)19-12-10-18(11-13-19)24(3,4)5;1-16(2)15-30-18-9-11-19(12-10-18)31(28,29)26-23-14-17(3)25-27(23)22-8-4-7-21-20(22)6-5-13-24-21;1-16-14-22(26-30(28,29)19-10-8-18(9-11-19)23(2,3)4)27(25-16)21-7-5-6-17-15-24-13-12-20(17)21;1-15(2)29-17-9-11-18(12-10-17)30(27,28)25-22-14-16(3)24-26(22)21-8-4-7-20-19(21)6-5-13-23-20/h6-15,27H,1-5H3;4-14,16,26H,15H2,1-3H3;5-15,26H,1-4H3;4-15,25H,1-3H3.

What are the key properties of 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide?

4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide has a molecular weight of 1714.15 g/mol, XLogP of 18.84, 21 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-N-(2-isoquinolin-5-yl-5-methylpyrazol-3-yl)benzenesulfonamide;4-tert-butyl-N-[5-methyl-2-(2-methylquinolin-5-yl)pyrazol-3-yl]benzenesulfonamide;4-(2-methylpropoxy)-N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)benzenesulfonamide;N-(5-methyl-2-quinolin-5-ylpyrazol-3-yl)-4-propan-2-yloxybenzenesulfonamide is sourced from PubChem (CID 158062843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).