N-[(3-methoxyphenyl)carbamothioyl]furan-2-carboxamide
Basic information
- CAS
82366-70-9- Standard SMILES
COc1cccc(NC(=S)NC(=O)c2ccco2)c1- InChIKey
XTBOQDIJRVWQFI-UHFFFAOYSA-N- Molecular formula
- C13H12N2O3S
- Average molar mass
- 276.31 g/mol
- Monoisotopic mass
- 276.05686342
Names & identifiers
- Preferred name
- N-[(3-methoxyphenyl)carbamothioyl]furan-2-carboxamide
- IUPAC
- N-[(3-methoxyphenyl)carbamothioyl]furan-2-carboxamide
Names & synonyms
N-[(3-methoxyphenyl)carbamothioyl]furan-2-carboxamideZINC267136STK027357ZINC0026713682366-70-9Oprea1_171793DTXSID70354608MFCD01962949AKOS000585963COc1cccc(c1)NC(=S)NC(=O)c1ccco1ZINC0000002671361(2FUROYL)3(3METHOXYPHENYL)THIOUREA
Show more names
ST502541071(FURAN2CARBONYL)3(3METHOXYPHENYL)THIOUREASR-01000369874COC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=CO2SR-01000369874-1N((3METHOXYPHENYL)CARBAMOTHIOYL)FURAN2CARBOXAMIDE2-furyl-N-{[(3-methoxyphenyl)amino]thioxomethyl}carboxamide2FURANCARBOXAMIDEN(((3METHOXYPHENYL)AMINO)THIOXOMETHYL)
Database identifiers
- CAS
82366-70-9- PubChem CID
- 776935
- DTXSID
DTXSID70354608- Nikkaji
- J1.703.464B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 95.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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