Basic information
- CAS
51661-14-4- Standard SMILES
CN(C)C(=S)SCC(=O)Nc1ccccc1- InChIKey
RGIZDISFFZUCIM-UHFFFAOYSA-N- Molecular formula
- C11H14N2OS2
- Average molar mass
- 254.4 g/mol
- Monoisotopic mass
- 254.05475542
Names & identifiers
- Preferred name
- (2-anilino-2-oxoethyl) N,N-dimethylcarbamodithioate
- IUPAC
- (2-anilino-2-oxoethyl) N,N-dimethylcarbamodithioate
Names & synonyms
51661-14-4(2-anilino-2-oxoethyl) N,N-dimethylcarbamodithioateNSC229072Enamine_000057CHEMBL1989347DTXSID40310594HMS1394C13AKOS001028462NSC-229072NCI60_0018672-Anilino-2-oxoethyl dimethylcarbamodithioate2-anilino-2-oxoethyl dimethyldithiocarbamate
Show more names
AE-848/33595032
Database identifiers
- CAS
51661-14-4- PubChem CID
- 313663
- DTXSID
DTXSID40310594- ChEMBL
CHEMBL1989347
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 89.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…