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7,9-diazaspiro(4.5)decane-6,8,10-trione, 8-thioxo-1,2,4-trimethyl-, sodium salt

HCID 23713005
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Basic information

CAS
63990-06-7
Standard SMILES
CC1CC(C)C2(C(=O)[N-]C(=S)NC2=O)C1C.[Na+]
InChIKey
WOSKONTXASGCAJ-UHFFFAOYSA-M
Molecular formula
C11H15N2NaO2S
Average molar mass
262.31 g/mol
Monoisotopic mass
262.07519318

Names & identifiers

Preferred name
7,9-diazaspiro(4.5)decane-6,8,10-trione, 8-thioxo-1,2,4-trimethyl-, sodium salt
IUPAC
sodium 1,3,4-trimethyl-8-sulfanylidene-7-aza-9-azanidaspiro[4.5]decane-6,10-dione

Names & synonyms

Sodium spiro(2,3,5-trimethylcyclopentane 2'-thiobarbiturate)Sodium 8-thioxo-1,2,4-trimethyl-7,9-diazaspiro(4.5)decane-6,8,10-trioneSodium spiro(2',3',5'-trimethylcyclopentane)-5,5-pyrimidine-2-thio-4,6-dione7,9-Diazaspiro(4.5)decane-6,8,10-trione, 8-thioxo-1,2,4-trimethyl-, sodium salt63990-06-7RefChem:310016

Database identifiers

CAS
63990-06-7
PubChem CID
23713005

Properties

Computed structural properties

Topological polar surface area
79.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
17
Formal charge
0
Complexity
388

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