N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-[[3-[[3-[(3-cyano-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-4-methoxyphenyl]sulfonylamino]phenyl]sulfonylamino]-1-hydroxynaphthalene-2-carboxamide (CHEM355147)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-09-01 07:13:21 UTC | ||||||||
| Update Date | 2026-09-01 07:13:21 UTC | ||||||||
| Accession Number | CHEM355147 | ||||||||
| Identification | |||||||||
| Common Name | N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-[[3-[[3-[(3-cyano-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-4-methoxyphenyl]sulfonylamino]phenyl]sulfonylamino]-1-hydroxynaphthalene-2-carboxamide | ||||||||
| Class | Small Molecule | ||||||||
| Description | N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-[[3-[[3-[(3-cyano-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-4-methoxyphenyl]sulfonylamino]phenyl]sulfonylamino]-1-hydroxynaphthalene-2-carboxamide has the chemical formula C54H58N8O9S2. With an average molecular weight of 1,027 g/mol, N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-[[3-[[3-[(3-cyano-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-4-methoxyphenyl]sulfonylamino]phenyl]sulfonylamino]-1-hydroxynaphthalene-2-carboxamide is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C54H58N8O9S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 1026.377 g/mol | ||||||||
| CAS Registry Number | 62592-60-3 | ||||||||
| IUPAC Name | N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-[[3-[[3-[(3-cyano-5-oxo-1-phenyl-4h-pyrazol-4-yl)diazenyl]-4-methoxyphenyl]sulfonylamino]phenyl]sulfonylamino]-1-hydroxynaphthalene-2-carboxamide | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=CC(=C4)NS(=O)(=O)C5=CC(=C(C=C5)OC)N=NC6C(=NN(C6=O)C7=CC=CC=C7)C#N)O)C(C)(C)CC | ||||||||
| InChI Identifier | InChI=1S/C54H58N8O9S2/c1-8-53(3,4)35-24-26-47(43(30-35)54(5,6)9-2)71-29-16-15-28-56-51(64)42-33-44(40-22-13-14-23-41(40)50(42)63)61-73(68,69)38-21-17-18-36(31-38)60-72(66,67)39-25-27-48(70-7)45(32-39)57-58-49-46(34-55)59-62(52(49)65)37-19-11-10-12-20-37/h10-14,17-27,30-33,49,60-61,63H,8-9,15-16,28-29H2,1-7H3,(H,56,64) | ||||||||
| InChI Key | BIBDVUONOGUEJL-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
