Basic information
- Standard SMILES
CSc1sc(C#N)c(C)c1C(=O)C=CN(C)C- InChIKey
HAJWKLDWBMIBEJ-UHFFFAOYSA-N- Molecular formula
- C12H14N2OS2
- Average molar mass
- 266.4 g/mol
Names & identifiers
- Preferred name
- 4-(3-Dimethylamino-acryloyl)-3-methyl-5-methylsulfanylthiophene-2-carbonitrile
- IUPAC
- 4-[3-(dimethylamino)prop-2-enoyl]-3-methyl-5-methylsulfanylthiophene-2-carbonitrile
Names & synonyms
Maybridge4_002357SCHEMBL5755247HAJWKLDWBMIBEJ-UHFFFAOYSA-N4-(3-Dimethylamino-acryloyl)-3-methyl-5-methylsulfanyl-thiophene-2-carbonitrile4-(3-Dimethylamino-acryloyl)-3-methyl-5-methylsulfanylthiophene-2-carbonitrile
Database identifiers
- PubChem CID
- 536048
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 359
Related reactions
4 records
Compound notes
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