Urea, 1-(o-chlorophenyl)-3-(2,3-dihydro-3-oxothiazolo(3,2-a)benzimidazol-2-yl)-2-thio-, monohydrochloride
Basic information
- CAS
27150-11-4- Standard SMILES
Cl.O=C1C(NC(=S)Nc2ccccc2Cl)Sc2nc3ccccc3n21- InChIKey
NSEOULYZKNEHFH-UHFFFAOYSA-N- Molecular formula
- C16H12Cl2N4OS2
- Average molar mass
- 411.3 g/mol
- Monoisotopic mass
- 409.9829588
Names & identifiers
- Preferred name
- Urea, 1-(o-chlorophenyl)-3-(2,3-dihydro-3-oxothiazolo(3,2-a)benzimidazol-2-yl)-2-thio-, monohydrochloride
- IUPAC
- 1-(2-chlorophenyl)-3-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-yl)thiourea;hydrochloride
Names & synonyms
27150-11-4Urea, 1-(o-chlorophenyl)-3-(2,3-dihydro-3-oxothiazolo(3,2-a)benzimidazol-2-yl)-2-thio-, monohydrochlorideRefChem:387532DTXSID80949903N'-(2-Chlorophenyl)-N-(3-oxo-2,3-dihydro[1,3]thiazolo[3,2-a][1,3]benzimidazol-2-yl)carbamimidothioic acid--hydrogen chloride (1/1)N'-(2-Chlorophenyl)-N-(3-oxo-2,3-dihydro[1,3]thiazolo[3,2-a]benzimidazol-2-yl)carbamimidothioic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
27150-11-4- PubChem CID
- 3038331
- DTXSID
DTXSID80949903
Properties
Computed structural properties
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 522
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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