1-(4-Chlorophenyl)-1-(dimethylcarbamothioyl)-3,3-dimethylthiourea
Basic information
- CAS
92167-75-4- Standard SMILES
CN(C)C(=S)N(C(=S)N(C)C)c1ccc(Cl)cc1- InChIKey
KOLVIFZCRYDKFA-UHFFFAOYSA-N- Molecular formula
- C12H16ClN3S2
- Average molar mass
- 301.9 g/mol
- Monoisotopic mass
- 301.0474176
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-1-(dimethylcarbamothioyl)-3,3-dimethylthiourea
- IUPAC
- 1-(4-chlorophenyl)-1-(dimethylcarbamothioyl)-3,3-dimethylthiourea
Names & synonyms
92167-75-41-(4-chlorophenyl)-1-(dimethylcarbamothioyl)-3,3-dimethylthioureaNSC518811SCHEMBL14273126DTXSID20325808NSC-518811N-(4-Chlorophenyl)-N,N,N',N'-tetramethyl-2-imidodithiodicarbonic diamide
Database identifiers
- CAS
92167-75-4- PubChem CID
- 351124
- DTXSID
DTXSID20325808
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 292
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Compound notes
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