Basic information
- CAS
61388-72-5- Standard SMILES
Cc1cccc(N2C(=O)/C(=C/c3cccc(Cl)c3)NC2=S)c1- InChIKey
HOBCRWRQKUSBII-GDNBJRDFSA-N- Molecular formula
- C17H13ClN2OS
- Average molar mass
- 328.8 g/mol
- Monoisotopic mass
- 328.0437119
Names & identifiers
- Preferred name
- 4-Imidazolidinone, 5-((3-chlorophenyl)methylene)-3-(3-methylphenyl)-2-thioxo-
- IUPAC
- (5Z)-5-[(3-chlorophenyl)methylidene]-3-(3-methylphenyl)-2-sulfanylideneimidazolidin-4-one
Names & synonyms
4-IMIDAZOLIDINONE, 5-((3-CHLOROPHENYL)METHYLENE)-3-(3-METHYLPHENYL)-2-THIOXO-61388-72-5RefChem:1070959BRN 09250655-((3-Chlorophenyl)methylene)-3-(3-methylphenyl)-2-thioxo-4-imidazolidinone
Database identifiers
- CAS
61388-72-5- PubChem CID
- 6434612
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 493
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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