Basic information
- CAS
172469-99-7- Standard SMILES
CC(=O)Nc1c(Sc2cc(C)cc(C)c2)c(C)c[nH]c1=O- InChIKey
FATTXJGHNGENGH-UHFFFAOYSA-N- Molecular formula
- C16H18N2O2S
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.10889899
Names & identifiers
- Preferred name
- Acetamide, N-(4-((3,5-dimethylphenyl)thio)-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl)-
- IUPAC
- N-[4-(3,5-dimethylphenyl)sulfanyl-5-methyl-2-oxo-1H-pyridin-3-yl]acetamide
Names & synonyms
172469-99-7Acetamide, N-(4-((3,5-dimethylphenyl)thio)-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl)-CHEMBL3418803-Acetamido-5-methyl-4-((3',5'-dimethylphenyl)thio)pyridin-2(1H)-one3-Acetamido-5-methyl-4-[(3',5'-dimethylphenyl)thio]pyridin-2(1H)-oneAcetamide, N-[4-[(3,5-dimethylphenyl)thio]-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl]-SCHEMBL7012519DTXSID90169312BDBM50029672N-[4-(3,5-dimethylphenyl)sulfanyl-5-methyl-2-oxo-1H-pyridin-3-yl]acetamideN-{4-[(3,5-dimethylphenyl)sulfanyl]-5-methyl-2-oxo-1,2-dihydropyridin-3-yl}acetamideN-[4-(3,5-Dimethyl-phenylsulfanyl)-5-methyl-2-oxo-1,2-dihydro-pyridin-3-yl]-acetamide
Database identifiers
- CAS
172469-99-7- PubChem CID
- 464595
- DTXSID
DTXSID90169312- ChEMBL
CHEMBL341880- Nikkaji
- J713.240I
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 500
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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