Basic information
- CAS
477489-66-0- Standard SMILES
COc1ccc(C2SCCN2S(=O)(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-]- InChIKey
ANURDVVSQLTTQC-UHFFFAOYSA-N- Molecular formula
- C17H16N4O9S2
- Average molar mass
- 484.5 g/mol
Names & identifiers
- Preferred name
- 2-(4-Methoxy-3-nitrophenyl)-3-(4-methyl-3,5-dinitrophenyl)sulfonyl-1,3-thiazolidine
- IUPAC
- 2-(4-methoxy-3-nitrophenyl)-3-(4-methyl-3,5-dinitrophenyl)sulfonyl-1,3-thiazolidine
- English name
- Thiazolidine, 2-(4-methoxy-3-nitrophenyl)-3-[(4-methyl-3,5-dinitrophenyl)sulfonyl]- (9CI)
- Molecular formula
- C17H16N4O9S2
- Molecular weight
- 484.46034
Names & synonyms
Thiazolidine, 2-(4-methoxy-3-nitrophenyl)-3-[(4-methyl-3,5-dinitrophenyl)sulfonyl]- (9CI)
Database identifiers
- CAS
477489-66-0
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 218 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 811
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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