Ethyl [(5-methyl-1,2-oxazol-3-yl)carbamothioyl]carbamate
Basic information
- CAS
85156-34-9- Standard SMILES
CCOC(=O)NC(=S)Nc1cc(C)on1- InChIKey
LCJBDAKJBOPXSM-UHFFFAOYSA-N- Molecular formula
- C8H11N3O3S
- Average molar mass
- 229.26 g/mol
- Monoisotopic mass
- 229.05211239
Names & identifiers
- Preferred name
- Ethyl [(5-methyl-1,2-oxazol-3-yl)carbamothioyl]carbamate
- IUPAC
- ethyl N-[(5-methyl-1,2-oxazol-3-yl)carbamothioyl]carbamate
Names & synonyms
85156-34-9ethyl [(5-methyl-1,2-oxazol-3-yl)carbamothioyl]carbamateDTXSID801146902AKOS022902432Carbamic acid, [[(5-methyl-3-isoxazolyl)amino]thioxomethyl]-, ethyl ester
Database identifiers
- CAS
85156-34-9- PubChem CID
- 15567985
- DTXSID
DTXSID801146902
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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