Basic information
- Standard SMILES
COc1c(C(=O)Nc2nnnn2C)ccc(C(F)(F)F)c1SC- InChIKey
MJKSKMOECMNLCE-UHFFFAOYSA-N- Molecular formula
- C12H12F3N5O2S
- Average molar mass
- 347.32 g/mol
Names & identifiers
- Preferred name
- 2-methoxy-3-(methylsulfanyl)-N-(1-methyl-1H-tetrazol-5-yl)-4-(trifluoromethyl)benzamide
- IUPAC
- 2-methoxy-3-methylsulfanyl-N-(1-methyltetrazol-5-yl)-4-(trifluoromethyl)benzamide
Names & synonyms
2-methoxy-3-(methylsulfanyl)-N-(1-methyl-1H-tetrazol-5-yl)-4-(trifluoromethyl)benzamideSCHEMBL15212580
Database identifiers
- PubChem CID
- 89768792
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 428
Related reactions
2 records
Compound notes
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