Basic information
- Standard SMILES
CS(=O)c1cccc(Cn2cc(Cl)cc(C(N)=O)c2=N)c1.Cl- InChIKey
YNTLSSIGSYNKJC-UHFFFAOYSA-N- Molecular formula
- C14H15Cl2N3O2S
- Average molar mass
- 360.3 g/mol
- Monoisotopic mass
- 359.0262033
Names & identifiers
- Preferred name
- 5-Chloro-2-imino-1-[3-(methylsulfinyl)benzyl]-1,2-dihydropyridine-3-carboxamide hydrochloride
- IUPAC
- 5-chloro-2-imino-1-[(3-methylsulfinylphenyl)methyl]pyridine-3-carboxamide;hydrochloride
Names & synonyms
SCHEMBL1262493YNTLSSIGSYNKJC-UHFFFAOYSA-N5-chloro-2-imino-1-[3-(methylsulfinyl)benzyl]-1,2-dihydropyridine-3-carboxamide hydrochloride
Database identifiers
- PubChem CID
- 66969795
Properties
Computed structural properties
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 544
Related reactions
4 records
Compound notes
Loading…