2-(1-Naphthyl)-N-[2,2,2-trichloro-1-({[(2-iodophenyl)amino]carbonothioyl}amino)ethyl]acetamide
Basic information
- CAS
351004-02-9- Standard SMILES
O=C(Cc1cccc2ccccc12)NC(NC(=S)Nc1ccccc1I)C(Cl)(Cl)Cl- InChIKey
YOXAJLPQPROHSL-UHFFFAOYSA-N- Molecular formula
- C21H17Cl3IN3OS
- Average molar mass
- 592.7 g/mol
- Monoisotopic mass
- 590.92026
Names & identifiers
- Preferred name
- 2-(1-Naphthyl)-N-[2,2,2-trichloro-1-({[(2-iodophenyl)amino]carbonothioyl}amino)ethyl]acetamide
- IUPAC
- 2-naphthalen-1-yl-N-[2,2,2-trichloro-1-[(2-iodophenyl)carbamothioylamino]ethyl]acetamide
- English name
- 2-Naphthalen-1-yl-N-(2,2,2-trichloro-1-(3-(2-I-Ph)-thioureido)-ethyl)-acetamide
- Molecular weight
- 0
Names & synonyms
2-(1-Naphthyl)-N-[2,2,2-trichloro-1-({[(2-iodophenyl)amino]carbonothioyl}amino)ethyl]acetamideCBDivE_003574AKOS0244191792-NAPHTHALEN-1-YL-N-(2,2,2-TRICHLORO-1-(3-(2-I-PH)-THIOUREIDO)-ETHYL)-ACETAMIDE
Database identifiers
- CAS
351004-02-9- PubChem CID
- 2831464
- EC Number
- 148-212-3
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 607
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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