Basic information
- CAS
20886-88-8- Standard SMILES
CCN(CC)CC(=O)Nc1sc2c(c1C(N)=O)CCCC2- InChIKey
XNSAWMOLVHCLRE-UHFFFAOYSA-N- Molecular formula
- C15H23N3O2S
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.15109816
Names & identifiers
- Preferred name
- 2-[[2-(Diethylamino)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
- IUPAC
- 2-[[2-(diethylamino)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Names & synonyms
20886-88-82-[[2-(Diethylamino)acetyl]amino]-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide2-[2-(diethylamino)acetylamino]-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxam ide2-[(N,N-diethylglycyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamideCBMicro_022505SCHEMBL5462770DTXSID201129475CCG-9721AKOS0002822012-[[2-(diethylamino)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamideST026277BIM-0022613.P001
Show more names
Z55136074
Database identifiers
- CAS
20886-88-8- PubChem CID
- 699441
- DTXSID
DTXSID201129475
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 387
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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