Basic information
- Standard SMILES
CCOC(=O)c1c(NC(C)=O)sc2ccccc12- InChIKey
DXSZZVLIKNFFIF-UHFFFAOYSA-N- Molecular formula
- C13H13NO3S
- Average molar mass
- 263.31 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-acetamido-1-benzothiophene-3-carboxylate
- IUPAC
- ethyl 2-acetamido-1-benzothiophene-3-carboxylate
Names & synonyms
7311-77-5ethyl 2-acetamido-1-benzothiophene-3-carboxylateethyl 2-(acetylamino)-1-benzothiophene-3-carboxylateethyl 2-acetamidobenzo[b]thiophene-3-carboxylatestarbld00354812-Acetylamino-benzo[b]thiophene-3-carboxylic acid ethyl esterOprea1_069144SCHEMBL5165684DXSZZVLIKNFFIF-UHFFFAOYSA-NBBL001890MFCD00194519STK279799
Show more names
AKOS003799451VS-00918ethyl 2-acetamidobenzothiophene-3-carboxylateST45137565ethyl 2-(acetylamino)benzo[b]thiophene-3-carboxylateF2779-0148
Database identifiers
- PubChem CID
- 3722285
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 334
Related reactions
3 records
Compound notes
Loading…