Basic information
- Standard SMILES
CSc1sc(-c2cc(Nc3cccc(O)c3)ccc2C)c(-c2cccnc2)c1C#N- InChIKey
ZXMOGIRPGNDMAH-UHFFFAOYSA-N- Molecular formula
- C24H19N3OS2
- Average molar mass
- 429.6 g/mol
Names & identifiers
- Preferred name
- 5-[5-(3-Hydroxy-phenylamino)-2-methyl-phenyl]-2-methylsulfanyl-4-pyridin-3-yl-thiophene-3-carbonitrile
- IUPAC
- 5-[5-(3-hydroxyanilino)-2-methylphenyl]-2-methylsulfanyl-4-pyridin-3-ylthiophene-3-carbonitrile
Names & synonyms
SCHEMBL5758382ZXMOGIRPGNDMAH-UHFFFAOYSA-N5-[5-(3-hydroxy-phenylamino)-2-methyl-phenyl]-2-methylsulfanyl-4-pyridin-3-yl-thiophene-3-carbonitrile5-[5-(3-hydroxyphenylamino)-2-methyl-phenyl]-2-methylsulfanyl-4-pyridin-3-yl-thiophene-3-carbonitrile
Database identifiers
- PubChem CID
- 22019037
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 611
Related reactions
3 records
Compound notes
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