7-[[4-[[4-[(2-cyanoimino-4,6-dioxo-1,3-diazinan-5-yl)diazenyl]benzoyl]amino]-2-ethoxyphenyl]diazenyl]naphthalene-1,3-disulfonic acid (CHEM346145)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 15:12:37 UTC | ||||||||
| Update Date | 2026-08-31 15:12:37 UTC | ||||||||
| Accession Number | CHEM346145 | ||||||||
| Identification | |||||||||
| Common Name | 7-[[4-[[4-[(2-cyanoimino-4,6-dioxo-1,3-diazinan-5-yl)diazenyl]benzoyl]amino]-2-ethoxyphenyl]diazenyl]naphthalene-1,3-disulfonic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C30H23N9O10S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 733.101 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 7-[[4-[[4-[(2-cyanoimino-4,6-dioxo-1,3-diazinan-5-yl)diazenyl]benzoyl]amino]-2-ethoxyphenyl]diazenyl]naphthalene-1,3-disulfonic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCOC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N=NC3C(=O)NC(=NC#N)NC3=O)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)O)S(=O)(=O)O | ||||||||
| InChI Identifier | InChI=1S/C30H23N9O10S2/c1-2-49-24-13-19(33-27(40)16-3-6-18(7-4-16)36-39-26-28(41)34-30(32-15-31)35-29(26)42)9-10-23(24)38-37-20-8-5-17-11-21(50(43,44)45)14-25(22(17)12-20)51(46,47)48/h3-14,26H,2H2,1H3,(H,33,40)(H,43,44,45)(H,46,47,48)(H2,32,34,35,41,42) | ||||||||
| InChI Key | YNIWXRTXOPEMLZ-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 | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
