Basic information
- Standard SMILES
CCCCN(CCCC)c1ccc(C=Cc2ccc(C(C#N)=C(C#N)C#N)s2)c(OCc2ccccc2)c1- InChIKey
OQBHAZKJEDJMMA-UHFFFAOYSA-N- Molecular formula
- C32H32N4OS
- Average molar mass
- 520.7 g/mol
Names & identifiers
- Preferred name
- 2-[5-[2-(2-Benzyloxy-4-dibutylaminophenyl)vinyl]thiophene-2-yl]-3-cyano-2-butenedinitrile
- IUPAC
- 2-[5-[2-[4-(dibutylamino)-2-phenylmethoxyphenyl]ethenyl]thiophen-2-yl]ethene-1,1,2-tricarbonitrile
Names & synonyms
SCHEMBL10008945OQBHAZKJEDJMMA-UHFFFAOYSA-N2-[5-[2-(2-benzyloxy-4-dibutylaminophenyl)vinyl]thiophene-2-yl]-3-cyano-2-butenedinitrile
Database identifiers
- PubChem CID
- 86667604
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 914
Related reactions
1 records
Compound notes
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