Basic information
- Standard SMILES
Cc1ccc(Cl)cc1NC(=S)n1c(C)c(C)c2ccccc21- InChIKey
SSRGDOMFVGPNLR-UHFFFAOYSA-N- Molecular formula
- C18H17ClN2S
- Average molar mass
- 328.9 g/mol
Names & identifiers
- Preferred name
- N-(5-Chloro-2-methylphenyl)-2,3-dimethyl-1H-indole-1-carbothioic acid amide
- IUPAC
- N-(5-chloro-2-methylphenyl)-2,3-dimethylindole-1-carbothioamide
Names & synonyms
SCHEMBL8140516SSRGDOMFVGPNLR-UHFFFAOYSA-NN-(5-Chloro-2-methylphenyl)-2,3-dimethyl-1H-indole-1-carbothioic acid amide
Database identifiers
- PubChem CID
- 9840417
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 416
Related reactions
2 records
Compound notes
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