Methyl 2-({[(4-ethoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)benzoate
methyl 2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoate
Also Known As: SR-01000235240-1|methyl 2-(3-(4-ethoxy-3-nitrobenzoyl)thioureido)benzoate|methyl 2-({[(4-ethoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)benzoate|methyl 2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoate
CAS: 428475-90-5
| Molecular Formula | C18H17N3O6S |
|---|---|
| Molecular Weight | 403.0838 g/mol |
| LogP | 2.9069 |
| Topological Polar Surface Area | 119.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.0838 |
| Monoisotopic Mass | 403.0838 |
| Heavy Atoms | 28 |
| Complexity | 931.287 |
Chemical Identifiers
| CAS Number | 428475-90-5 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-] |
Product Overview
Methyl 2-({[(4-ethoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)benzoate (CAS 428475-90-5), with molecular formula C18H17N3O6S and molecular weight 403.0838 g/mol. IUPAC: methyl 2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Methyl 2-({[(4-ethoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)benzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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