2-Propenamide, N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-3-(2-thienyl)-
Basic information
- CAS
875195-10-1- Standard SMILES
O=C(C=Cc1cccs1)NC(=S)Nc1ccc(N=Nc2ccccc2)cc1- InChIKey
WSIYGQCJDCZKKC-UHFFFAOYSA-N- Molecular formula
- C20H16N4OS2
- Average molar mass
- 392.5 g/mol
- Monoisotopic mass
- 392.07655349
Names & identifiers
- Preferred name
- 2-Propenamide, N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-3-(2-thienyl)-
- IUPAC
- N-[(4-phenyldiazenylphenyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide
Names & synonyms
DTXSID2010409022-Propenamide, N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-3-(2-thienyl)-875195-10-1
Database identifiers
- CAS
875195-10-1- PubChem CID
- 4939748
- DTXSID
DTXSID201040902
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 552
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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