4-[[2-ethoxy-5-[(4-pentoxyphenyl)carbamothioylamino]phenyl]methoxy]benzenesulfonic acid (CHEM342752)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 10:24:31 UTC | ||||||||
| Update Date | 2026-08-31 10:24:31 UTC | ||||||||
| Accession Number | CHEM342752 | ||||||||
| Identification | |||||||||
| Common Name | 4-[[2-ethoxy-5-[(4-pentoxyphenyl)carbamothioylamino]phenyl]methoxy]benzenesulfonic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 4-[[2-ethoxy-5-[(4-pentoxyphenyl)carbamothioylamino]phenyl]methoxy]benzenesulfonic acid is a chemical compound with the formula C27H32N2O6S2. With an average molecular weight of 544.70 g/mol, 4-[[2-ethoxy-5-[(4-pentoxyphenyl)carbamothioylamino]phenyl]methoxy]benzenesulfonic acid is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C27H32N2O6S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 544.170 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 4-[[2-ethoxy-5-[(4-pentoxyphenyl)carbamothioylamino]phenyl]methoxy]benzenesulfonic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCCCOC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OCC)COC3=CC=C(C=C3)S(=O)(=O)O | ||||||||
| InChI Identifier | InChI=1S/C27H32N2O6S2/c1-3-5-6-17-34-23-10-7-21(8-11-23)28-27(36)29-22-9-16-26(33-4-2)20(18-22)19-35-24-12-14-25(15-13-24)37(30,31)32/h7-16,18H,3-6,17,19H2,1-2H3,(H2,28,29,36)(H,30,31,32) | ||||||||
| InChI Key | UJJLSGCSQUVRSD-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 | |||||||||
| 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 | ||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
