Basic information
- CAS
31913-93-6- Standard SMILES
CNC(=O)c1ccccc1Sc1ccccc1- InChIKey
SVISFQCKOJHBDJ-UHFFFAOYSA-N- Molecular formula
- C14H13NOS
- Average molar mass
- 243.33 g/mol
- Monoisotopic mass
- 243.07178504
Names & identifiers
- Preferred name
- N-methyl-2-(phenylthio)benzamide
- IUPAC
- N-methyl-2-phenylsulfanylbenzamide
Names & synonyms
N-methyl-2-(phenylthio)benzamide31913-93-6N-methyl-2-phenylsulfanylbenzamideNSC266307Maybridge3_000653N-METHYL-2-(PHENYLSULFANYL)BENZAMIDESCHEMBL11750773DTXSID30313130SVISFQCKOJHBDJ-UHFFFAOYSA-NHMS1432N15NSC-266307IDI1_012040
Database identifiers
- CAS
31913-93-6- PubChem CID
- 320119
- DTXSID
DTXSID30313130- Nikkaji
- J1.522.125I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 251
Related reactions
9 records
Compound notes
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